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International Journal of I)R Re SWART 4 Mass Spectrometry ELSEVIER International Journal of Mass Spectrometry 227 (2003: 617-618 www.elsevier.com/locate/ijms Author index Volume 227 Amunugama, R., 1, 339 Gilbert, T.M., 361 Mo, O., 401 Andersen, L.H., 273 Morton, T.H., 175 Anderson, J.D., 63 Hansen, K., 87 Mourgues, P., 373, 381 Anderson, S.E., 205 Hase, W.L., 315 Murrell, J., 223 Angelova, G., 273 Hayes, L.A., 111 Armentrout, P.B., 47, 289 Herlert, A., 87 Nakagawa, F., 391 Arnold, S.T., 413 Heydorn, L.N., 453 Asfandiarov, N.L., 259, 281 Hiizumi, K., 391 Ochran, R.A., 471 Audier, H.E., 373, 381 Hiraoka, K., 391 O’Hair, R.A.J., 47 Ho, Y.-P., 97 Ohanessian, G., 439, 509 Baker, E.S., 205 Hoppilliard, Y., 439 Operti, L., 235 Beauchamp, J.L., 147 Blagojevic, V., 161 lino, T., 391 Paulsen, E.S., 63 Bluhme, H., 273 Ishida, M., 391 Petrie, S., 33 Bohme, D.K., 161, 563 Pisterzi, L.F., 161 Bouchonnet, S., 175 Jacquet, J.P., 381 Pshenichnyuk, S.A., 259, 281 Bouchoux, G., 479 Jarvis, M.J.Y., 161 Bowers, M.T., 205 Jeanville, PM., 247 Rabezzana, R., 235 Burgers, P.C., 453 Jellen, E.E., 111 Rebrion-Rowe, C., 273 Burkell, J.L., 497 Julian, R.R., 147 Riveros, J.M., 135, 315 Rodgers, M.T., 1, 339 Casares, A., 217 Kemper, P.R., 205 Rogalewicz, F., 439 Chappell, A.M., 111 Kim, M.S., 21 Ruttink, P.J.A., 453 Check, C.E., 361 Kish, M.M., 191, 509 Ryzhov, V., 111 Choe, J.C., 21 Konn, D.O., 223 Corral, I., 401 Koyanagi, G.K., 161, 563 Schréder, D., Krouse, I.H., 303 Schwarz, H.., Deakyne, C.A., 555, 601 Schweikhard, L., 87 Dearden, D.V., 63 Lardin, H.A., 303 Seiersen, K., 273 Denhez, J.P., 381 Le Caér, S., 587 Sena, M., 135, 315 Despeyroux, D., 223 Le Garrec, J.L., 273 Serafin, S.V., 175 Dixon, D.A., 421 Li, H.-P., 97 Song, K., 315 Djazi, F.V., 479 Li, L., 555 Styles, M.L., 47 Liebman, J.F., 555 Sun, L., 315 Estapé, E.S., 247 Lifshitz, C., 77 Sunderlin, L.S., 361 Liyanage, R., 47 Fal’ko, V.S., 259, 281 Lobring, K.C., 361 Takao, K., 391 Fee, D.P., 205 Lu, L.-C., 97 Terlouw, J.K., 453 Feller, D., 421 Lukin, V.G., 259, 281 Thissen, R., 373 Fossey, J., 373, 381 Torres-Negron de Jeanville, I., 247 Francisco, J.S., 421 Maitre, P., 587 Turco, F., 235 Fridgen, T.D., 497 Mayer, P.M., 471 Turecek, F., 327 Fujita, K., 391 McMahon, T.B., 497 Meot-Ner (Mautner), M., 525 Underwood, N.J., 223 Gaillard, F., 479 Mestdagh, H., 587 Geller, O., 77 Miller, T.M., 413 Vaglio, G.A., 235 Gidden, J., 205 Mitchell, J.B.A., 273 Vierezet, D., 479 doi: 10.1016/S 1387-3806(03)00280-X 618 Author index Viggiano, A.A., 413 Wesdemiotis, C., 191, 509 Yafiez, M., 401 Vogel, M., 87 Wisniewski, E.S., 577 Yoon, S.H., 21 Wollnik, H., 217 Welford Castleman Jr., A., 577 Zhan, C.-G., 421 Wenthold, P.G., 303 Yamabe, S., 391 Zhang, K., 175 International Journai of -¥ ¥. :. As ELSEVIER Mass Spectrometry International Journal of Mass Spectrometry 227 (2003) 619-625 www.elsevier.com/locate/ijms Subject index Volume 227 Ab initio calculations Basicity Sequential bond energies of Pt (NH3), (x = 1-4) determined by The proton affinity scale, and effects of ion structure and collision-induced dissociation and theory, 47 solvation, 525 The gas and solution phase acidities of HNO, HOONO, HONO, Proton affinities and gas-phase basicities: theoretical methods and HONO;, 421 and structural effects, 601 Tautomerization and dissociation of ethylene phosphonate ions Benzene [OCH>CH,O]P(H)O °: an experimental and CBS-QB3 compu- Kinetics and thermodynamics for the bonding of benzene to 20 tational study, 453 main-group atomic cations: formation o7 half-sandwiches, full- Aerosol sandwiches and beyond, 563 Abiotic synthesis of ATP from AMP in the gas phase: implica- Benzoylecgonine tions for the origin of biologically important molecules from The effect of liquid chromatography eluents and additives on the small molecular clusters, 147 positive ion responses of cocaine, benzoylecgonine, and ecgonine methyl ester using electrospray ionization, 247 Dissociation energies of silver clusters Ag* ,n = 14, 15, 16, 18, Bidentate bases 87 Application of the kinetic method to bifunctional bases. MIKE Agnostic interactions and CID-MIKE test cases, 479 Binding energies of Cu’ to saturated and «,f-unsaturated Blackbody-induced dissociation alkanes, silanes and germanes. The role of agostic interactions, Dissociation of p-cymene molecular ions induced by thermal 401 radiation, 135 Alkali metal Bond dissociation energies Alkali metal binding energies of dibenzo-18-crown-6: experi- Cation-t interactions with a model for an extended m network. mental and computational results, 63 Absolute binding energies of alkali metal cation—naphthalene Alkali metal ions complexes determined by threshold collision-induced dissocia- Cation-7 interactions with a model for an extended m network. tion and theoretical studies, | Absolute binding energies of alkali metal cation—naphthalene Influence of substituents on cation-n interactions. 3. Absolute complexes determined by threshold collision-induced dissocia- binding energies of alkali metal cation—aniline complexes tion and theoretical studies, | determined by threshold collision-induced dissociation and Influence of substituents on cation-1 interactions. 3. Absolute theoretical studies, 339 binding energies of alkali metal cation—aniline complexes Bond energies determined by threshold collision-induced dissociation and Guided ion beam studies of transition metal—ligand thermo- theoretical studies, 339 chemistry, 289 Amino acids Bond strength Structures and fragmentations of zinc(II) complexes of amino G3 and G2 thermochemistry of sulfur fluoride neutrals and anions, acids in the gas phase. IV. Solvent effect on the structure of 413 electrosprayed ions, 439 Branching ratios The Na’ affinities of «-amino acids: side-chain substituent Branching ratios for the dissociative recombination of hydro- effects, 509 carbon ions. I: The cases of CysHy’ and CH; , 273 API/MS The effect of liquid chromatography eluents and additives on the Calculation positive ion responses of cocaine, benzoylecgonine, and ecgo- Proton affinity of some radicals of alcohols, ethers and amines, 373 nine methyl ester using electrospray ionization, 247 Gas phase basicity of silanaldehydes and silanones, 381 ATP Capping agents Abiotic synthesis of ATP from AMP in the gas phase: implica- 3-Dimensional structural characterization of cationized polyhe- tions for the origin of biologically important molecules from dral oligomeric silsesquioxanes (POSS) with styryl and pheny- small molecular clusters, 147 lethyl capping agents, 205 doi: 10.1016/S 1387-3806(03)0028 1-1 620 Subject index Catalysis complexes determined by threshold collision-induced dissocia- Tautomerization and dissociation of ethylene phosphonate ions tion and theoretical studies, | [OCH,CH,O]P(H)O *: an experimental and CBS-QB3 compu- Sequential bond energies of Pt (NH3), (x = 1-4) determined by tational study, 453 collision-induced dissociation and theory, 47 Cation-n interactions Binding of metalloporphyrins to model nitrogen bases: collision- Cation-n interactions with a model for an extended 7 network. induced dissociation and ion—molecule reaction studies, 111 Absolute binding energies of alkali metal cation—naphthalene Influence of substituents on cation-m interactions. 3. Absolute complexes determined by threshold collision-induced dissocia- binding energies of alkali metal cation—aniline complexes tion and theoretical studies, 1 determined by threshold collision-induced dissociation and Influence of substituents on cation-m interactions. 3. Absolute theoretical studies, 339 binding energies of alkali metal cation—aniline complexes Condensation reaction determined by threshold collision-induced dissociation and Condensation reaction vs. ligand exchange with first-row transi- theoretical studies, 339 tion metal cations: a theoretical study of Cu’ heteroleptic model CBS-QB3 complexes, 587 Tautomerization and dissociation of ethylene phosphonate ions Coulomb explosion [-OCH.»CH,O-]P(H)=O**: an experimental and CBS-QB3 Comparison of methyl and hydroxyl protons generated in a computational study, 453 Coulomb explosion event: application of a time-of-flight gating 4-Center transition state technique to methanol clusters, 577 Stereochemical analysis of deuterated alkyl chains by charge- Covalent bonds remote fragmentations of protonated parent ions, 175 Guided ion beam studies of transition metal—ligand thermo- Charge solvation chemistry, 289 The Na’ affinities of «-amino acids: side-chain substituent Crown ether effects, 509 Alkali metal binding energies of dibenzo-18-crown-6: experi- Chiroselective octamer of serine mental and computational results, 63 An electrospray ionization-flow tube study of H/D exchange in Cu the protonated serine dimer and protonated serine dipeptide, 77 Gas-phase kinetic measurements and quantum chemical Chloro-substitution effects calculations of the ligation of Ni’, Cu’, Ni’ (pyrrole), > and How does chlorine substitution on acetonitrile affect the internal Cu‘ (pyrrole), >w ith O, and CO, 161 Sx2 isomerization of proton-bound pairs (CICH,CN)(ROH)H ° Cu” affinities (R = CH, C>Hs, C3H7)?, 471 Binding energies of Cu’ to saturated and «,B-unsaturated alkanes, CID silanes and germanes. The role of agostic interactions, 401 Gas-phase ion chemistry and ion thermochemistry of phenyltri- p-Cymene molecular ion fluorosilane, 303 Dissociation of p-cymene molecular ions induced by thermal New measuofr thee themrmoechenmisttry sof SF;" andSF, , 361 radiation, 135 Cluster ion Thermochemical stabilities of the gas-phase cluster ions Density functional theory H;C '(N3),,, 391 Stereochemical analysis of deuterated alkyl chains by charge- How does chlorine substitution on acetonitrile affect the internal remote fragmentations of protonated parent ions, 175 Sx2 isomerization of proton-bound pairs (CICH»CN)(ROH)H 2,5-DHB (R = CH;, CHs, C3H?)?, 471 Temperature dependence of dissociative electron attachment to Clusters molecules of gentisic acid, hydroquinone and p-benzoquinone, Guided ion beam studies of transition metal-ligand thermo- 281 chemistry, 289 1,3,2-Dioxaphospholane Comparison of methyl and hydroxyl protons generated in a Tautomerization and dissociation of ethylene phosphonate ions Coulomb explosion event: application of a time-of-flight gating [OCH>CH,O]P(H)O *: an experimental and CBS-QB3 compu- technique to methanol clusters, 577 tational study, 453 co Dissociation energy Gas-phase kinetic measurements and quantum chemical calcu- Dissociation energies of silver clusters Ag*,n = 14, 15, 16, 18, lations of the ligation of Ni’, Cu’, Ni (pyrrole), and 87 Cu‘ (pyrrole), >w ith O. and CO, 161 Dissociation of p-cymene molecular ions induced by thermal Cocaine radiation, 135 The effect of liquid chromatography eluents and additives on the Dissociative attachment positive ion responses of cocaine, benzoylecgonine, and ecgo- Temperature dependencies of negative ions formation by capture nine methyl ester using electrospray ionization, 247 of low-energy electrons for some typical MALDI matrices, 259 Collision-induced dissociation Temperature dependence of dissociative electron attachment to Cation-n interactions with a model for an extended 7 network. molecules of gentisic acid, hydroquinone and p-benzoquinone, Absolute binding energies of alkali metal cation—naphthalene 281 Subject index Dissociative recombination Flowing afterglow Branching ratios for the dissociative recombination of hydro- New measurements of the thermochemistry of SF; and SF, , carbon ions. I: The cases of CsHy* and C,H; °, 273 361 Dissociative resonance structures Fluoride affinity Stereochemical analysis of deuterated alkyl chains by charge- G3 and G2 thermochemistry of sulfur fluoride neutrals and remote fragmentations of protonated parent ions, 175 anions, 413 Distonic ions Franck—Condon effects Proton affinity of some radicals of alcohols, ethers and amines, The use of kinetic isotope effects for the determination of 373 internal energy distributions in isolated transient species in Dynamical studies the gas phase, 327 Comparison of methyl and hydroxyl protons generated in a Free electrons Coulomb explosion event: application of a time-of-flight gating Temperature dependencies of negative ions formation by capture technique to methanol clusters, 577 of !ow-energy electrons for some typical MALDI matrices, 259 Dynamics FT-ICR 3-Dimensional structural characterization of cationized polyhe- Proton affinity of some radicals of alcohols, ethers and amines, dral oligomeric silsesquioxanes (POSS) with styryl and phenyl- 373 ethyl capping agents, 205 G2 Ecgonine methyl ester G3 and G2 thermochemistry of sulfur fluoride neutrals < The effect of liquid chromatography eluents and additives on the anions, 413 positive ion responses of cocaine, benzoylecgonine, and ecgo- G3 nine methyl ester using electrospray ionization, 247 G3 and G2 thermochemistry of sulfur fluoride neutrals < Electron affinity anions, 413 G3 and G2 thermochemistry of sulfur fluoride neutrals and G2(MP2) anions, 413 G3 and G2 thermochemistry of sulfur fluoride neutrals ¢ Electrospray anions, 413 Structures and fragmentations of zinc(II) complexes of amino G3(MP2) acids in the gas phase. IV. Solvent effect on the structure of G3 and G2 thermochemistry of sulfur fluoride neutrals < electrosprayed ions, 439 anions, 413 Energetic fragments Gas basicity Comparison of methyl and hydroxyl protons generated in a Proton affinity of some radicals of alcohols, ethers and amines, Coulomb explosion event: application of a time-of-flight gating 373 technique to methanol clusters, 577 Gas phase basicity of silanaldehydes and silanones, 381 Energetics Gas phase The proton affinity scale, and effects of ion structure and Alkali metal binding energies of dibenzo-!8-crown-6: experi- solvation, 525 mental and computational results, 63 Proton affinities and gas-phase basicities: theoretical methods Gas phase acidity and structural effects, 601 The gas and solution phase acidities of HNO, HOONO, HONO, Energy-resolved MS and HONO;, 421 Gas-phase ion chemistry and ion thermochemistry of phenyltri- Gas-phase acidities and sites of deprotonation of 2-ketones and fluorosilane, 303 structures of the corresponding enolates, 497 Enzymatic digestion Gas phase basicity Probing the interactions of oxidized insulin chain A and metal Application of the kinetic method to bifunctional bases. MIKE ions using electrospray ionization mass spectrometry, 97 and CID-MIKE test cases, 479 ESI Gas-phase equilibria An electrospray ionization-flow tube study of H/D exchange Thermochemical stabilities of the gas-phase cluster ions in the protonated serine dimer and protonated serine dipeptide, H3C"(N>),,, 391 77 Gas-phase ion chemistry Gas-phase ion chemistry and ion thermochemistry of phenyltri- Femtosecond dynamics fluorosilane, 303 Comparison of methyl and hydroxyl protons generated in a Guided ion beam Coulomb explosion event: application of a time-of-flight gating Cation-z interactions with a model for an extended m network. technique to methanol clusters, 577 Absolute binding energies of alkali metal cation—naphthalene Flow tube complexes determined by threshold collision-induced dissocia- An electrospray ionization-flow tube study of H/D exchange tion and theoretical studies, 1 in the protonated serine dimer and protonated serine dipeptide, Sequential bond energies ofP t’ (NH3), (x = 1-4) determined by 77 collision-induced dissociation and theory, 47 Subject index Guided ion beam studies of transition metal—ligand thermo- Ionization energies chemistry, 289 Thermochemistry of neutral and cationic iron hydroxides Influence of substituents on cation-n interactions. 3. Absolute Fe(OH),."* (n = 1, 2) in the gas phase, 121 binding energies of alkali metal cation—aniline complexes Ion-ligand binding determined by threshold collision-induced dissociation and Competition between m- and o-based interactions in metal ion theoretical studies, 339 complexes of the phenyl radical, 33 Ion—molecule reactions H/D exchange Binding of metalloporphyrins to model nitrogen bases: collision- An electrospray ionization-flow tube study of H/D exchange in induced dissociation and ion—molecule reaction studies, the protonated serine dimer and protonated serine dipeptide, 77 111 High pressure mass spectrometer Iron halides Thermochemical stabilities of the gas-phase cluster ions Thermochemistry of neutral and cationic iron hydroxides H;C '(N3),,, 391 Fe(OH),,"* (n = 1, 2) in the gas phase, 121 HPMS Iron hydroxides Gas-phase acidities and sites of deprotonation of 2-ketones and Thermochemistry of neutral and cationic iron hydroxides structures of the corresponding enolates, 497 Fe(OH),,”"* (n = 1, 2) in the gas phase, 121 Hybrid density functional theory Isoelectronic species Competition between 1- and o-based interactions in metal ion The structure and energetics of [B, C, F, H;]°: quantum chem- complexes of the phenyl radical, 33 istry shows multiple minima, 555 Hydrogen bonds Isomeric structures The proton affinity scale, and effects of ion structure and The structure and energetics of [B, C, F, H3]°: quantum chem- solvation, 525 istry shows multiple minima, 555 The structure and energetics of [B, C, F, H;] : quantum chem- Isomerization istry shows multiple minima, 555 Structures and fragmentations of zinc(II) complexes of amino Proton affinities and gas-phase basicities: theoretical methods acids in the gas phase. IV. Solvent effect on the structure of and structural effects, 601 electrosprayed ions, 439 Hydrogen bridges Isomers The structure and energetics of [B, C, F, H;]: quantum chem- Branching ratios for the dissociative recombination of hydro- istry shows multiple minima, 555 carbon ions. I: The cases of C,H)’ and CyHs', 273 ICP-SIFT Keto—enol tautomerization Gas-phase kinetic measurements and quantum chemical calcu- Stereochemical analysis of deuterated alkyl chains by lations of the ligation of Ni’, Cu’, Ni (pyrrole), and charge-remote fragmentations of protonated parent ions, Cu (pyrrole), » with O, and CO, 161 175 Insulin chain A 2-Ketones Probing the interactions of oxidized insulin chain A and metal Gas-phase acidities and sites of deprotonation of 2-ketones and ions using electrospray ionization mass spectrometry, 97 structures of the corresponding enolates, 497 Internal energy distribution functions Kinetic isotope effects The use of kinetic isotope effects for the determination of The use of kinetic isotope effects for the determination of internal energy distributions in isolated transient species in internal energy distributions in isolated transient species in the gas phase, 327 the gas phase, 327 Internal lysine residues Kinetic method Selective cleavage at internal lysine residues in protonated vs. Gas phase basicity of silanaldehydes and silanones, 381 metalated peptides, 191 Application of the kinetic method to bifunctional bases. MIKE Jon clusters and CID-MIKE test cases, 479 Gas-phase ion chemistry in silane/propyne mixtures, 235 The Na’ affinities of «-amino acids: side-chain substituent Ion solvation effects, 509 The proton affinity scale, and effects of ion structure and Kinetics solvation, 525 Kinetics and thermodynamics for the bonding of benzene to 20 Ion thermochemistry main-group atomic cations: formation of half-sandwiches, full- Gas-phase ion chemistry and ion thermochemistry of phenyltri- sandwiches and beyond, 563 fluorosilane, 303 lon trap mass spectrometry LC Gas-phase ion chemistry in silane/propyne mixtures, 235 The effect of liquid chromatography eluents and additives lon—dipole potential on the positive ion responses of cocaine, benzoylecgonine, Stationary points for the OH +CH3,F — CH,OH+F potential and ecgonine methyl ester using electrospray ionization, energy surface, 315 247 Subject index Ligand exchange Metal—peptide interactions Condensation reaction vs. ligand exchange with first-row transi- Probing the interactions of oxidized insulin chain A and metal tion metal cations: a theoretical study of Cu" heteroleptic model ions using electrospray ionization mass spectrometry, 97 complexes, 587 MIKE spectrometry Ligation Anisotropic photodissociation of vinyl chloride molecular cation Gas-phase kinetic measurements and quantum chemical calcu- in the ground and first excited electronic states, 21 lations of the ligation of Ni’, Cu’, Ni’ (pyrrole), and Cu (pyrrole), >w ith O2 and CO, 161 Negative ions Kinetics and thermodynamics for the bonding of benzene to 20 Temperature dependencies of negative ions formation by capture main-group atomic cations: formation of half-sandwiches, full- of low-energy electrons for some typical MALDI matrices, sandwiches and beyond, 563 259 Long-lived excited state Temperature dependence of dissociative electron attachment to Anisotropic photodissociation of vinyl chloride molecular cation molecules of gentisic acid, hydroquinone and p-benzoquinone, in the ground and first excited electronic states, 21 281 Neutralization—reionization mass spectrometry Main-group atomic cations The use of kinetic isotope effects for the determination of Kinetics and thermodynamics for the bonding of benzene to 20 internal energy distributions in isolated transient species in main-group atomic cations: formation of half-sandwiches, full- the gas phase, 327 sandwiches and beyond, 563 Ni’ Main-group metal ions Gas-phase kinetic measurements and quantum chemical calcu- Competition between m- and o-based interactions in metal ion lations of the ligation of Ni’, Cu’, Ni (pyrrole), and complexes of the phenyl radical, 33 Cu (pyrrole), >w ith O, and CO, 161 MALDI Noncovalent bonds Temperature dependencies of negative ions formation by capture Guided ion beam studies of transition metal-ligand thermo- of low-energy electrons for some typical MALDI matrices, chemistry, 289 259 Temperature dependence of dissociative electron attachment to O, molecules of gentisic acid, hydroquinone and p-benzoquinone, 281 Gas-phase kinetic measurements and quantum chemical calcu- Mass accuracy lations of the ligation of Ni’, Cu’, Ni (pyrrole),;,> and An energy-isochronous multi-pass time-of-flight mass spectro- Cu (pyrrole), » with O2 and CO, 161 meter consisting of two coaxial electrostatic mirrors, 217 Organoborane halide Mass measurements The structure and energetics of [B, C, F, H;]’: quantum chem- An energy-isochronous multi-pass time-of-flight mass spectro- istry shows multiple minima, 555 meter consisting of two coaxial electrostatic mirrors, 217 Origin of life Mass spectrometry Abiotic synthesis of ATP from AMP in the gas phase: implica- Thermochemistry of neutral and cationic iron hydroxides tions for the origin of biologically important molecules from Fe(OH),.”* (n = 1, 2) in the gas phase, 121 small molecular clusters, 147 Master equation 2-Oxide Dissociation of p-cymene molecular ions induced by thermal Tautomerization and dissociation of ethylene phosphonate ions radiation, 135 [OCH>CH,O]P(H)O *: an experimental and CBS-QB3 compu- Metalated complexes tational study, 453 Probing the interactions of oxidized insulin chain A and metal ions using electrospray ionization mass spectrometry, Phenyl radical 97 Competition between m- and o-based interactions in metal ion Metalated peptides complexes of the phenyl radical, 33 Selective cleavage at internal lysine residues in protonated vs. Phenyltrifluorosilane metalated peptides, 191 Gas-phase ion chemistry and ion thermochemistry of phenyltri- Metal-ligand complexes fluorosilane, 303 Sequential bond energies ofP t (NH3), (x = 1-4) determined by Phosphate collision-induced dissociation and theory, 47 Abiotic synthesis of ATP from AMP in the gas phase: implica- Metalloporphyrin-ligand binding tions for the origin of biologically important molecules from Binding of metalloporphyrins to model nitrogen bases: collision- small molecular clusters, 147 induced dissociation and ion—molecule reaction studies, 111 Phosphonate/phosphite tautomerism Metalloporphyrins Tautomerization and dissociation of ethylene phosphonate ions Binding of metalloporphyrins to model nitrogen bases: collision- [OCH>CH,O}P(H)O : an experimental and CBS-QB3 compu- induced dissociation and ion—molecule reaction studies, 111 tational study, 453 624 Subject index Photodissociation RRKM calculations Anisotropic photodissociation of vinyl chloride molecular cation The use of kinetic isotope effects for the determination of in the ground and first excited electronic states, 21 internal energy distributions in isolated transient species in Potential energy surface the gas phase, 327 Stationary points for the OH” +CH3F — CH;OH+F potential energy surface, 315 Salt bridge Propyne Abiotic synthesis of ATP from AMP in the gas phase: implica- Gas-phase ion chemistry in silane/propyne mixtures, 235 tions for the origin of biologically important molecules from Proteins small molecular clusters, 147 Studies into the selective accumulation of multiply charged The Na’ affinities of «%-amino acids: side-chain substituent protein ions in a quadrupole ion trap mass spectrometer, effects, 509 223 Selective accumulation Proton affinity Studies into the selective accumulation of multiply charged Proton affinity of some radicals of alcohols, ethers and amines, protein ions in a quadrupole ion trap mass spectrometer, 373 223 Gas phase basicity of silanaldehydes and silanones, 381 Selective cleavage C-terminal to lysine Application of the kinetic method to bifunctional bases. MIKE Selective cleavage at internal lysine residues in protonated vs. and CID-MIKE test cases, 479 metalated peptides, 191 The proton affinity scale, and effects of ion structure and Sequential bond energies solvation, 525 Sequential bond energies of Pt (NH3), (x = 1-4) determined by Proton affinities and gas-phase basicities: theoretical methods collision-induced dissociation and theory, 47 and structural effects, 601 SF; Protonated peptides New measurements of the thermochemistry of SF;" and SF, , Selective cleavage at internal lysine residues in protonated vs. 361 metalated peptides, 191 SF, Protonated serine dimer New measurements of the thermochemistry of SF; and SF, , An electrospray ionization-flow tube study of H/D exchange in 361 the protonated serine dimer and protonated serine dipeptide, 77 SF Proton-bound dimer G3 and G2 thermochemistry of sulfur fluoride neutrals < Gas phase basicity of silanaldehydes and silanones, 381 anions, 413 Pt (NH;3), SF, Sequential bond energies of Pt’ (NH3), (x = 1-4) determined by G3 and G2 thermochemistry sulfur fluoride neutrals ¢ collision-induced dissociation and theory, 47 anions, 413 Pyrrole SF, Gas-phase kinetic measurements and quantum chemical calcu- G3 and G2 thermochemistry . sulfur fluoride neutrals 2 lations of the ligation of Ni’, Cu’, Ni (pyrrole), and anions, 413 Cu (pyrrole); > with O, and CO, 161 SF; G3 and G2 thermochemistry F sulfur fluoride neutrals < QCISD(T) anions, 413 The structure and energetics of [B, C, F, H3]°: quantum chem- SF; istry shows multiple minima, 555 G3 and G2 thermochemistry F sulfur fluoride neutrals 4 Quadrupole ion trap mass spectrometry anions, 413 Studies into the selective accumulation of multiply charged SF, protein ions in a quadrupole ion trap mass spectrometer, 223 G3 and G2 thermochemistry r sulfur fluoride neutrals ¢ Quid-pro-quo anions, 413 Tautomerization and dissociation of ethylene phosphonate ions SF, [OCH,CH,O]P(H)O °: an experimental and CBS-QB3 compu- G3 and G2 thermochemistry f sulfur fluoride neutrals < tational study, 453 anions, 413 SF; Reactivity of vinylsilanes and germanes G3 and G2 thermochemistry f sulfur fluoride neutrals <¢ Binding energies of Cu’ to saturated and «,f-unsaturated anions, 413 alkanes, silanes and germanes. The role of agostic interactions, SF; 401 G3 and G2 thermochemistry F sulfur fluoride neutrals Reflectron anions, 413 3-Dimensional structural characterization of cationized polyhe- SF, dral oligomeric silsesquioxanes (POSS) with styryl and pheny- G3 and G2 thermochemistry f sulfur fluoride neutrals 2 lethyl capping agents, 205 anions, 413 Subject index SFe Thermochemistry G3 and G2 thermochemistry of sulfur fluoride neutrals and Guided ion beam studies of transition metal—ligand thermo- anions, 413 chemistry, 289 SF New measurements of the thermochemistry of SF;~ and SF, , G3 and G2 thermochemistry of sulfur fluoride neutrals and 361 anions, 413 The proton affinity scale, and effects of ion structure and Silanaldehydes solvation, 525 Gas phase basicity of silanaldehydes and silanones, 381 Proton affinities and gas-phase basicities: theoretical methods Silane and structural effects, 601 Gas-phase ion chemistry in silane/propyne mixtures, 235 Thermodynamics Silanones Kinetics and thermodynamics for the bonding of benzene to 20 Gas phase basicity of silanaldehydes and silanones, 381 main-group atomic cations: formation of half-sandwiches, full- Silver clusters sandwiches and beyond, 563 Dissociation energies of silver clusters Ag’ ,n = 14, 15, 16, 18,87 Time-of-flight mass spectrometer Sn2 reactions An energy-isochronous multi-pass time-of-flight mass spectro- Stationary points for the OH” + CH3;F — CH;,0H+F potential meter consisting of two coaxial electrostatic mirrors, 217 energy surface, 315 Transition metal Sodium ion affinities Condensation reaction vs. ligand exchange with first-row transi- The Na’ affinities of o-amino acids: side-chain substituent tion metal cations: a theoretical study of Cu’ heteroleptic model effects, 509 complexes, 587 Solvation effects Transition metal ions The gas and solution phase acidities of HNO, HOONO, HONO, Guided ion beam studies of transition metal-ligand thermo- and HONO;, 421 chemistry, 289 Solvent effects Structures and fragmentations of zinc(II) complexes of amino Unimolecular reactions acids in the gas phase. IV. Solvent effect on the structure of How does chlorine substitution on acetonitrile affect the internal electrosprayed ions, 439 Sx2 isomerization of proton-bound pairs (CICHCN)(ROH)H ° Structural effects (R = CH;, C>Hs, C3H7)?, 471 Proton affinities and gas-phase basicities: theoretical methods and structural effects, 601 Vicinal elimination Substituent effects Stereochemical analysis of deuterated alkyl chains by charge- Proton affinities and gas-phase basicities: theoretical methods remote fragmentations of protonated parent ions, 175 and structural effects, 601 Vinyl chloride ion SWIFT Anisotropic photodissociation of vinyl chloride molecular cation Studies into the selective accumulation of multiply charged in the ground and first excited electronic states, 21 protein ions in a quadrupole ion trap mass spectrometer, 223 VUV photoionisation Proton affinity of some radicals of alcohols, ethers and amines, Tandem mass spectrometry 373 Probing the interactions of oxidized insulin chain A and metal ions using electrospray ionization mass spectrometry, 97 Zinc Tautomerization and dissociation of ethylene phosphonate ions Structures and fragmentations of zinc(II) complexes of amino [OCH,CH,O]P(H)O °: an experimental and CBS-QB3 compu- acids in the gas phase. IV. Solvent effect on the structure of tational study, 453 electrosprayed ions, 439 How does chlorine substitution on acetonitrile affect the internal Zwitterion Sx2 isomerization of proton-bound pairs (CICH»CN)(ROH)H * Stereochemical analysis of deuterated alkyl chains by charge- remote fragmentations of protonated parent ions, 175 (R = CH;, C>Hs, C;H;)?, 471