-
1
-
-
0004600228
-
+: A Comparative Photoelectron-Photoion Coincidence Study of 1,2-Epoxypropane and Acetone
-
+ A Comparative Photoelectron-Photoion Coincidence Study of 1,2-Epoxypropane and Acetone . Chem. Phys. 72:1982;259-266.
-
(1982)
Chem. Phys.
, vol.72
, pp. 259-266
-
-
Bombach, R.1
Stadelmann, J.-P.2
Vogt, J.3
-
7
-
-
0035908618
-
+ Cations: A He-Iα Photoelectron-Photoion Coincidence Study of Propanal
-
+ Cations A He-Iα Photoelectron-Photoion Coincidence Study of Propanal . Int. J. Mass Spectrom. 208:2001;147-157.
-
(2001)
Int. J. Mass Spectrom.
, vol.208
, pp. 147-157
-
-
Dannacher, J.1
Stadelmann, J.-P.2
-
8
-
-
84994974068
-
Ion-Neutral Complexes in Unimolecular Decompositions
-
McAdoo D.J. Ion-Neutral Complexes in Unimolecular Decompositions. Mass Spectrom. Rev. 7:1988;363-393.
-
(1988)
Mass Spectrom. Rev.
, vol.7
, pp. 363-393
-
-
McAdoo, D.J.1
-
9
-
-
0001064447
-
Alkane Eliminations from Ions in the Gas Phase
-
McAdoo D.J., Bowen R.D. Alkane Eliminations from Ions in the Gas Phase. Eur. Mass Spectrom. 5:1999;389-409.
-
(1999)
Eur. Mass Spectrom.
, vol.5
, pp. 389-409
-
-
McAdoo, D.J.1
Bowen, R.D.2
-
11
-
-
84985478819
-
Positive Ion Fragmentation Mechanisms of Some Simple Aldehydes and Epoxides and Trimethylene Oxide
-
Pritchard J.G. Positive Ion Fragmentation Mechanisms of Some Simple Aldehydes and Epoxides and Trimethylene Oxide. Org. Mass Spectrom. 8:1974;103-108.
-
(1974)
Org. Mass Spectrom.
, vol.8
, pp. 103-108
-
-
Pritchard, J.G.1
-
21
-
-
0037543596
-
-
Gaussian, Inc.: Pittsburgh, PA
-
Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Scuseria, G. E.; Robb, M. A.; Cheeseman, J. R.; Zakrzewski, V. G.; Montgomery, J. A., Jr.; Stratmann, R. E.; Burant, J. C.; Dapprich, S.; Millam, J. M.; Daniels, A. D.; Kudin, K. N.; Strain, M. C.; Farkus, O.; Tomasi, J.; Barone, V.; Cossi, M.; Cammi, R.; Mennucci, B.; Pomelli, C.; Adamo, C.; Clifford, S.; Ochterski, J.; Petersson, G. A.; Ayala, P. Y.; Cui, Q.; Morokuma, K.; Malick, D. K.; Rabuck, A. D.; Raghavachari, K.; Foresman, J. B.; Cioslowski, J.; Ortiz, J. V.; Baboul, A. G.; Stefanov, B. B.; Liu, G.; Liashenko, A.; Piskorz, P.; Komaromi, I.; Gomperts, R.; Martin, R. L.; Fox, D. J.; Keith, T.; Al-Laham, M. A.; PengC. Y.; Nanayakkara, A.; Challacombe, M.; Gill, P. M. W.; Johnson, B.; Chen, W.; Wong, M. W.; Andres, J. L.; Gonzalez, C.; Head-Gordon, M.; Replogle, E. S.; Pople, J. A. Gaussian, Inc.: Pittsburgh, PA, 1998.
-
(1998)
-
-
Frisch, M.J.1
Trucks, G.W.2
Schlegel, H.B.3
Scuseria, G.E.4
Robb, M.A.5
Cheeseman, J.R.6
Zakrzewski, V.G.7
Montgomery J.A., Jr.8
Stratmann, R.E.9
Burant, J.C.10
Dapprich, S.11
Millam, J.M.12
Daniels, A.D.13
Kudin, K.N.14
Strain, M.C.15
Farkus, O.16
Tomasi, J.17
Barone, V.18
Cossi, M.19
Cammi, R.20
Mennucci, B.21
Pomelli, C.22
Adamo, C.23
Clifford, S.24
Ochterski, J.25
Petersson, G.A.26
Ayala, P.Y.27
Cui, Q.28
Morokuma, K.29
Malick, D.K.30
Rabuck, A.D.31
Raghavachari, K.32
Foresman, J.B.33
Cioslowski, J.34
Ortiz, J.V.35
Baboul, A.G.36
Stefanov, B.B.37
Liu, G.38
Liashenko, A.39
Piskorz, P.40
Komaromi, I.41
Gomperts, R.42
Martin, R.L.43
Fox, D.J.44
Keith, T.45
Al-Laham, M.A.46
Peng, C.Y.47
Nanayakkara, A.48
Challacombe, M.49
Gill, P.M.W.50
Johnson, B.51
Chen, W.52
Wong, M.W.53
Andres, J.L.54
Gonzalez, C.55
Head-Gordon, M.56
Replogle, E.S.57
Pople, J.A.58
more..
-
22
-
-
0011083273
-
Harmonic Vibrational Frequencies: An Evaluation of Hartree-Fock, Møller-Plessett, Quadratic Configuration Interaction, Density Functional Theory, and Semiempirical Scale Factors
-
Scott A.P., Radom L. Harmonic Vibrational Frequencies An Evaluation of Hartree-Fock, Møller-Plessett, Quadratic Configuration Interaction, Density Functional Theory, and Semiempirical Scale Factors . J. Phys. Chem. 100:1996;16502-16513.
-
(1996)
J. Phys. Chem.
, vol.100
, pp. 16502-16513
-
-
Scott, A.P.1
Radom, L.2
-
23
-
-
33845279666
-
Competing Reactions of the Acetone Cation Radical: RRKM-QET Calculations on an ab Initio Potential Energy Surface
-
Heinrich N., Louage F., Lifshitz C., Schwarz H. Competing Reactions of the Acetone Cation Radical RRKM-QET Calculations on an ab Initio Potential Energy Surface . J. Am. Chem. Soc. 110:1988;8183-8192.
-
(1988)
J. Am. Chem. Soc.
, vol.110
, pp. 8183-8192
-
-
Heinrich, N.1
Louage, F.2
Lifshitz, C.3
Schwarz, H.4
-
25
-
-
0001205529
-
Unimolecular Decompositions of Ionized Isopropyl Methyl Ether: An ab Initio and RRKM Study
-
Olivella S., Solé A., McAdoo D.J., Griffin L.L. Unimolecular Decompositions of Ionized Isopropyl Methyl Ether An ab Initio and RRKM Study . J. Am. Chem. Soc. 117:1995;2557-2564.
-
(1995)
J. Am. Chem. Soc.
, vol.117
, pp. 2557-2564
-
-
Olivella, S.1
Solé, A.2
McAdoo, D.J.3
Griffin, L.L.4
-
26
-
-
0000776684
-
Theoretical Analysis of the Unimolecular Gas-Phase Decompositions of the Propane Molecular Ion
-
McAdoo D.J., Olivella S., Solé A. Theoretical Analysis of the Unimolecular Gas-Phase Decompositions of the Propane Molecular Ion. J. Phys. Chem. A. 102:1998;10798-10804.
-
(1998)
J. Phys. Chem. A
, vol.102
, pp. 10798-10804
-
-
McAdoo, D.J.1
Olivella, S.2
Solé, A.3
-
29
-
-
0000571416
-
Isotope and Temperature Effects on the Kinetics of Low-Pressure Association Reactions of Protonated Acetone with Acetone by Fourier Transform Ion Cyclotron Resonance Spectroscopy
-
Thölmann D., McCormick A., McMahon T.B. Isotope and Temperature Effects on the Kinetics of Low-Pressure Association Reactions of Protonated Acetone with Acetone by Fourier Transform Ion Cyclotron Resonance Spectroscopy. J. Phys. Chem. 98:1994;1156-1160.
-
(1994)
J. Phys. Chem.
, vol.98
, pp. 1156-1160
-
-
Thölmann, D.1
McCormick, A.2
McMahon, T.B.3
-
30
-
-
36549095692
-
An Improved Algorithm for Reaction Path Following
-
Gonzalez C., Schlegel H.B. An Improved Algorithm for Reaction Path Following. J. Chem. Phys. 90:1989;2154-2161.
-
(1989)
J. Chem. Phys.
, vol.90
, pp. 2154-2161
-
-
Gonzalez, C.1
Schlegel, H.B.2
-
31
-
-
33750614386
-
Reaction Path Following in Mass-Weighted Internal Coordinates
-
Gonzalez C., Schlegel H.B. Reaction Path Following in Mass-Weighted Internal Coordinates. J. Phys. Chem. 90:1990;5523-5527.
-
(1990)
J. Phys. Chem.
, vol.90
, pp. 5523-5527
-
-
Gonzalez, C.1
Schlegel, H.B.2
-
32
-
-
0000841587
-
Incorrect Dissociation Behavior of Radical Ions in Density Functional Calculations
-
Bally T., Sastry G.H. Incorrect Dissociation Behavior of Radical Ions in Density Functional Calculations. J. Phys. Chem. A. 101:1997;7923-7925.
-
(1997)
J. Phys. Chem. A.
, vol.101
, pp. 7923-7925
-
-
Bally, T.1
Sastry, G.H.2
-
33
-
-
0037881424
-
+· in the Metastable Decompositions of Ionized Ethyl Formate
-
+· in the Metastable Decompositions of Ionized Ethyl Formate. Org. Mass Spectrom. 27:1992;1384-1388.
-
(1992)
Org. Mass Spectrom.
, vol.27
, pp. 1384-1388
-
-
Hudson, C.E.1
McAdoo, D.J.2
-
34
-
-
0001998551
-
Gas-Phase Ion and Neutral Thermochemistry
-
Lias S.G., Bartmess J.E., Liebman J.F., Holmes J.L., Levin R.D., Mallard W.G. Gas-Phase Ion and Neutral Thermochemistry. J. Phys. Chem. Ref. Data. 17:1988;76-97.
-
(1988)
J. Phys. Chem. Ref. Data
, vol.17
, pp. 76-97
-
-
Lias, S.G.1
Bartmess, J.E.2
Liebman, J.F.3
Holmes, J.L.4
Levin, R.D.5
Mallard, W.G.6
-
35
-
-
0001881389
-
Ionization and Dissociation by Electron Impact
-
Stevenson D.P. Ionization and Dissociation by Electron Impact. Disc. Faraday Soc. 10:1951;35-45.
-
(1951)
Disc. Faraday Soc.
, vol.10
, pp. 35-45
-
-
Stevenson, D.P.1
-
36
-
-
84978548545
-
Ionisation et Fragmentation en Spectrometrie de Masse - I: Sur la Repartition de la Charge Positive entre Fragments Provenant de Mêmes Ruptures
-
Audier H.E. Ionisation et Fragmentation en Spectrometrie de Masse - I: Sur la Repartition de la Charge Positive entre Fragments Provenant de Mêmes Ruptures. Org. Mass Spectrom. 2:1969;283-298.
-
(1969)
Org. Mass Spectrom.
, vol.2
, pp. 283-298
-
-
Audier, H.E.1
-
37
-
-
0009164851
-
Substituent Effects in Unimolecular Ion Decompositions. XV. Interpretations and the Quasi-Equilibrium Theory
-
McLafferty F.W., Wachs T.Lifshitz; C., Innorta G., Irving P. Substituent Effects in Unimolecular Ion Decompositions. XV. Interpretations and the Quasi-Equilibrium Theory. J. Am. Chem. Soc. 92:1970;6867-6879.
-
(1970)
J. Am. Chem. Soc.
, vol.92
, pp. 6867-6879
-
-
McLafferty, F.W.1
Wachs T.Lifshitz2
, C.3
Innorta, G.4
Irving, P.5
-
38
-
-
84989040450
-
Heat of Formation for the Propanoyl Cation by Photoionization Mass Spectrometry
-
Traeger J.C. Heat of Formation for the Propanoyl Cation by Photoionization Mass Spectrometry. Org. Mass Spectrom. 20:1984;223-227.
-
(1984)
Org. Mass Spectrom.
, vol.20
, pp. 223-227
-
-
Traeger, J.C.1
-
40
-
-
0000936379
-
A Study of the Allyl Cation Thermochemistry by Photoionization Mass Spectrometry
-
Traeger J.C. A Study of the Allyl Cation Thermochemistry by Photoionization Mass Spectrometry. Int. J. Mass Spectrom. Ion Processes. 58:1984;259-271.
-
(1984)
Int. J. Mass Spectrom. Ion Processes
, vol.58
, pp. 259-271
-
-
Traeger, J.C.1
-
41
-
-
33845556986
-
Absolute Heats of Formation for Gas-Phase Cations
-
Traeger J.C., McLoughlin R.G. Absolute Heats of Formation for Gas-Phase Cations. J. Am. Chem. Soc. 103:1981;2647-3652.
-
(1981)
J. Am. Chem. Soc.
, vol.103
, pp. 2647-3652
-
-
Traeger, J.C.1
McLoughlin, R.G.2
-
42
-
-
37049093923
-
·+, the Central Intermediate in the Isomerization-Dissociation Reactions of Ionized Vinyl Alcohol
-
·+, the Central Intermediate in the Isomerization-Dissociation Reactions of Ionized Vinyl Alcohol. J. Chem. Soc. Chem. Commun. 1983;1497-1499.
-
(1983)
J. Chem. Soc. Chem. Commun.
, pp. 1497-1499
-
-
Apeloig, Y.1
Karni, M.2
Ciommer, B.3
Depke, G.4
Frenking, G.5
Meyn, S.6
Schmidt, J.7
Schwarz, H.8
-
43
-
-
0002882878
-
+ and H. An ab Initio Molecular Orbital Study
-
+ and H. An ab Initio Molecular Orbital Study. Int. J. Mass Spectrom. Ion Processes. 59:1984;21-37.
-
(1984)
Int. J. Mass Spectrom. Ion Processes
, vol.59
, pp. 21-37
-
-
Apeloig, Y.1
Karni, M.2
Ciommer, B.3
Depke, G.4
Frenking, G.5
Meyn, S.6
Schmidt, J.7
Schwarz, H.8
-
44
-
-
0000538368
-
Alkane Eliminations from Ionized Ketones in the Gas Phase: Dependence of Ion-Neutral-Complex-Mediated Decompositions on the Properties of the Ionic and Neutral Partners
-
Traeger J.C., Hudson C.E., McAdoo D.J. Alkane Eliminations from Ionized Ketones in the Gas Phase Dependence of Ion-Neutral-Complex-Mediated Decompositions on the Properties of the Ionic and Neutral Partners . J. Phys. Chem. 92:1988;1519-1523.
-
(1988)
J. Phys. Chem.
, vol.92
, pp. 1519-1523
-
-
Traeger, J.C.1
Hudson, C.E.2
McAdoo, D.J.3
-
45
-
-
0010779833
-
Energy Dependence of Ion-Induced Dipole Complex Mediated Alkane Eliminations from Ionized Ethers
-
Traeger J.C., Hudson C.E., McAdoo D.J. Energy Dependence of Ion-Induced Dipole Complex Mediated Alkane Eliminations from Ionized Ethers. J. Phys.Chem. 94:1990;5714-5717.
-
(1990)
J. Phys.Chem.
, vol.94
, pp. 5714-5717
-
-
Traeger, J.C.1
Hudson, C.E.2
McAdoo, D.J.3
|