-
1
-
-
0000556777
-
Gas phase organic ion-molecule reaction chemistry
-
Feng, W. Y., Gronert, S.: Gas phase organic ion-molecule reaction chemistry. Annu. Rep. Prog. Chem. B 95, 349-372 (1999)
-
(1999)
Annu. Rep. Prog. Chem. B
, vol.95
, pp. 349-372
-
-
Feng, W.Y.1
Gronert, S.2
-
2
-
-
0027971670
-
Simulations of gas-phase chemical reactions: Applications to SN2 nucleophilic substitution
-
Hase, W. L.: Simulations of gas-phase chemical reactions: Applications to SN2 nucleophilic substitution. Science 266, 998-1002 (1994)
-
(1994)
Science
, vol.266
, pp. 998-1002
-
-
Hase, W.L.1
-
3
-
-
77950207412
-
+ (bipy=2, 2'-bipyridine) with dimethyl ether in comparison with dimethyl sulfide: An experimental/computational study
-
+ (bipy=2, 2'-bipyridine) with dimethyl ether in comparison with dimethyl sulfide: An experimental/computational study. Chem. Eur. J. 16, 3962-3969 (2010)
-
(2010)
Chem. Eur. J.
, vol.16
, pp. 3962-3969
-
-
Butschke, B.1
Tabrizi, S.G.2
Schwarz, H.3
-
5
-
-
0035246350
-
Mass spectrometric studies of organic ion/molecule reactions
-
DOI 10.1021/cr9900836
-
Gronert, S.: Mass spectrometric studies of organic ion-molecule reactions. Chem. Rev. 101, 329-360 (2001) (Pubitemid 32325798)
-
(2001)
Chemical Reviews
, vol.101
, Issue.2
, pp. 329-360
-
-
Gronert, S.1
-
6
-
-
4644324569
-
Study on the reactions of pyridine with fluorine-containing compounds in the gas phase by electron impact/Fourier transfer ion cyclotron resonance mass spectrometry
-
He, P., Guo, Y. L., Zhu, S. Z.: Study on the reactions of pyridine with fluorine-containing compounds in the gas phase by electron impact/Fourier transfer ion cyclotron resonance mass spectrometry. J. Fluorine Chem. 125, 1537-1541 (2004)
-
(2004)
J. Fluorine Chem.
, vol.125
, pp. 1537-1541
-
-
He, P.1
Guo, Y.L.2
Zhu, S.Z.3
-
7
-
-
0030833838
-
Transacetalization with acylium ions. A structurally diagnostic ion/molecule reaction for cyclic acetals and ketals in the gas phase
-
DOI 10.1021/jo970116m
-
Moraes, L. A. B., Gozzo, F. C., Eberlin, M. N., Vainiotalo, P.: Transacetalization with acylium ions. A structurally diagnostic ion-molecule reaction for cyclic acetals and ketals in the gas phase. J. Org. Chem. 62, 5096-5103 (1997) (Pubitemid 27328166)
-
(1997)
Journal of Organic Chemistry
, vol.62
, Issue.15
, pp. 5096-5103
-
-
Moraes, L.A.B.1
Gozzo, F.C.2
Eberlin, M.N.3
Vainiotalo, P.4
-
8
-
-
0001861342
-
Analytical applications of ion-molecule reactions
-
Brodbelt, J. S.: Analytical applications of ion-molecule reactions. Mass Spectrom. Rev. 16, 91-110 (1997) (Pubitemid 127552742)
-
(1997)
Mass Spectrometry Reviews
, vol.16
, Issue.2
, pp. 91-110
-
-
Brodbelt, J.S.1
-
9
-
-
32944461836
-
Structurally diagnostic ion/molecule reactions: Class and functional-group identification by mass spectrometry
-
DOI 10.1002/jms.998
-
Eberlin, M. N.: Structurally diagnostic ion-molecule reactions: Class and functional-group identification by mass spectrometry. J. Mass Spectrom. 41, 141-156 (2006) (Pubitemid 43260154)
-
(2006)
Journal of Mass Spectrometry
, vol.41
, Issue.2
, pp. 141-156
-
-
Eberlin, M.N.1
-
10
-
-
0001469099
-
Ion-molecule reactions of perfluorotributylamine (FC43) cations with polycyclic aromatic hydrocarbons in a quadrupole ion trap
-
Mosi, A. A., Cullen, W. R., Eigendorf, G. K.: Ion-molecule reactions of perfluorotributylamine (FC43) cations with polycyclic aromatic hydrocarbons in a quadrupole ion trap. Int. J Mass Spectrom 190/191, 195-207 (1999)
-
(1999)
Int. J Mass Spectrom
, vol.190
, Issue.191
, pp. 195-207
-
-
Mosi, A.A.1
Cullen, W.R.2
Eigendorf, G.K.3
-
11
-
-
67649336592
-
An ion-molecule reaction for the identification of analytes with two basic functional groups
-
Fu, M. K., Duan, P. G., Li, S., Eismin, R. J., Kenttämaa, H. I.: An ion-molecule reaction for the identification of analytes with two basic functional groups. J. Am. Soc. Mass Spectrom. 20, 1251-1262 (2009)
-
(2009)
J. Am. Soc. Mass Spectrom.
, vol.20
, pp. 1251-1262
-
-
Fu, M.K.1
Duan, P.G.2
Li, S.3
Eismin, R.J.4
Kenttämaa, H.I.5
-
12
-
-
33847053560
-
+ Chemical Ionization and Collision-activated Dissociation in a Fourier Transform Ion Cyclotron Resonance Mass Spectrometer
-
DOI 10.1016/j.jasms.2006.10.009, PII S1044030506009524
-
2 chemical ionization and collision-activated dissociation in a Fourier transform ion cyclotron resonance mass spectrometer. J. Am. Soc. Mass Spectrom. 18, 525-540 (2007) (Pubitemid 46274381)
-
(2007)
Journal of the American Society for Mass Spectrometry
, vol.18
, Issue.3
, pp. 525-540
-
-
Somuramasami, J.1
Kenttamaa, H.I.2
-
13
-
-
77951206416
-
Identification and counting of carbonyl and hydroxyl functionalities in protonated bifunctional analytes by using solution derivatization prior to mass spectrometric analysis via ion-molecule reactions
-
Somuramasami, J., Winger, B. E., Gillespie, T. A., Kenttämaa, H. I.: Identification and counting of carbonyl and hydroxyl functionalities in protonated bifunctional analytes by using solution derivatization prior to mass spectrometric analysis via ion-molecule reactions. J. Am. Soc. Mass Spectrom. 21, 773-784 (2010)
-
(2010)
J. Am. Soc. Mass Spectrom.
, vol.21
, pp. 773-784
-
-
Somuramasami, J.1
Winger, B.E.2
Gillespie, T.A.3
Kenttämaa, H.I.4
-
14
-
-
1242271264
-
Ion-molecule reactions for mass spectrometric identification of functional groups in protonated oxygen-containing monofunctional compounds
-
DOI 10.1021/ac034946d
-
Watkins, M. A., Price, J. M., Winger, B. E., Kenttämaa, H. I.: Ion-molecule reactions for mass spectrometric identification of functional groups in protonated oxygen-containing monofunctional compounds. Anal. Chem. 76, 964-976 (2004) (Pubitemid 38235545)
-
(2004)
Analytical Chemistry
, vol.76
, Issue.4
, pp. 964-976
-
-
Watkins, M.A.1
Price, J.M.2
Winger, B.E.3
Kenttamaa, H.I.4
-
15
-
-
14744275394
-
Ion-molecule reactions for the characterization of polyols and polyol mixtures by ESI/FT-ICR mass spectrometry
-
DOI 10.1021/ac049031t
-
Watkins, M. A., Winger, B. E., Shea, R. C., Kenttämaa, H. I.: Ionmolecule reactions for the characterization of polyols and polyol mixtures by ESI/FT-ICR Mass Spectrometry. Anal. Chem. 77, 1385-1392 (2005) (Pubitemid 40327878)
-
(2005)
Analytical Chemistry
, vol.77
, Issue.5
, pp. 1385-1392
-
-
Watkins, M.A.1
Winger, B.E.2
Shea, R.C.3
Kenttamaa, H.I.4
-
16
-
-
34247555844
-
Functional group selective ion/molecule reactions: Mass spectrometric identification of the amido functionality in protonated monofunctional compounds
-
DOI 10.1021/jo0618223
-
Campbell, K. M., Watkins, M. A., Li, S., Fiddler, M. N., Winger, B., Kenttämaa, H. I.: Functional group selective ion-molecule reactions: Mass spectrometric identification of the amido functionality in protonated monofunctional compounds. J. Org. Chem. 72, 3159-3165 (2007) (Pubitemid 46668112)
-
(2007)
Journal of Organic Chemistry
, vol.72
, Issue.9
, pp. 3159-3165
-
-
Campbell, K.M.1
Watkins, M.A.2
Li, S.3
Fiddler, M.N.4
Winger, B.5
Kenttamaa, H.I.6
-
17
-
-
23744485605
-
Compound screening for the presence of the primary N-oxide functionality via ion-molecule reactions in a mass spectrometer
-
DOI 10.1021/ac050324b
-
Watkins, M. A., WeWora, D. V., Li, S., Winger, B. E., Kenttämaa, H. I.: Compound screening for the presence of the primary N-Oxide functionality via ion-molecule reactions in a mass spectrometer. Anal. Chem. 77, 5311-5316 (2005) (Pubitemid 41140850)
-
(2005)
Analytical Chemistry
, vol.77
, Issue.16
, pp. 5311-5316
-
-
Watkins, M.A.1
WeWora, D.V.2
Li, S.3
Winger, B.E.4
Kenttamaa, H.I.5
-
18
-
-
41149107356
-
Regioselective ion-molecule reactions for the mass spectrometric differentiation of protonated isomeric aromatic diamines
-
DOI 10.1039/b801961d
-
Fu, M., Duan, P., Li, S., Habicht, C. S., Pinkston, S. D., Vinueza, R. N., Kenttämaa, H. I.: Regioselective ion-molecule reactions for the mass spectrometric differentiation of protonated isomeric aromatic diamines. Analyst 132, 452-454 (2008) (Pubitemid 351441976)
-
(2008)
Analyst
, vol.133
, Issue.4
, pp. 452-454
-
-
Fu, M.1
Duan, P.2
Li, S.3
Habicht, S.C.4
Pinkston, D.S.5
Vinueza, N.R.6
Kenttamaa, H.I.7
-
19
-
-
46849088615
-
Identification of the aromatic tertiary N-oxide functionality in protonated analytes via ion/molecule reactions in mass spectrometers
-
DOI 10.1021/jo800309u
-
Duan, P., Gillespir, T. A., Winger, B. E., Kenttämaa, H. I.: Identification of the aromatic tertiary N-Oxide functionality in protonated analytes via ion-molecule reactions in mass spectrometers. J. Org. Chem. 73, 4888-4894 (2008) (Pubitemid 351956549)
-
(2008)
Journal of Organic Chemistry
, vol.73
, Issue.13
, pp. 4888-4894
-
-
Duan, P.1
Gillespie, T.A.2
Winger, B.E.3
Kenttamaa, H.I.4
-
20
-
-
0000467266
-
Unusual positive ion reagents in chemical ionization mass spectrometry
-
Vairamani, M., Mirza, U. A., Srinivas, R.: Unusual positive ion reagents in chemical ionization mass spectrometry. Mass Spectrom. Rev. 9, 235-258 (1990)
-
(1990)
Mass Spectrom. Rev.
, vol.9
, pp. 235-258
-
-
Vairamani, M.1
Mirza, U.A.2
Srinivas, R.3
-
21
-
-
0034716213
-
Development of chemical ionization mass spectrometry
-
DOI 10.1016/S1387-3806(00)00301-8, PII S1387380600003018
-
Munson, B.: Development of chemical ionization mass spectrometry. Int. J. Mass Spectrom. 200, 243-251 (2000) (Pubitemid 32015925)
-
(2000)
International Journal of Mass Spectrometry
, vol.200
, Issue.1-3
, pp. 243-251
-
-
Munson, B.1
-
22
-
-
84986959184
-
1, 2-Dibromoethane as a positive chemical ionization reagent: Application to geometrical isomers
-
Vairamani, M., Srinivas, R., Mirza, U. A.: 1, 2-Dibromoethane as a positive chemical ionization reagent: Application to geometrical isomers. Org. Mass Spectrom. 23, 620-621 (1988)
-
(1988)
Org. Mass Spectrom.
, vol.23
, pp. 620-621
-
-
Vairamani, M.1
Srinivas, R.2
Mirza, U.A.3
-
23
-
-
84989111484
-
Mass-spectral study of substituted methyl (E) - And (Z)-cinnamates under 1, 2-dibromoethane chemical ionization
-
Vairamani, M., Saraswathi, M., Rao, G. K. V.: Mass-spectral study of substituted methyl (E) - and (Z)-cinnamates under 1, 2-dibromoethane chemical ionization. Org. Mass Spectrom. 26, 786-788 (1991)
-
(1991)
Org. Mass Spectrom.
, vol.26
, pp. 786-788
-
-
Vairamani, M.1
Saraswathi, M.2
Rao, G.K.V.3
-
24
-
-
0030905814
-
Methyl iodide-an interesting reagent for positive ion chemical ionization
-
Partanen, T., Vainiotalo, P.: Methyl iodide-an interesting reagent for positive ion chemical ionization. Rapid Commun. Mass Spectrom. 11, 881-888 (1997)
-
(1997)
Rapid Commun. Mass Spectrom.
, vol.11
, pp. 881-888
-
-
Partanen, T.1
Vainiotalo, P.2
-
25
-
-
0038324562
-
Selective adduct formation by furan chemical ionization reagent in gas chromatography ion trap mass spectrometry
-
DOI 10.1002/jms.452
-
Tzing, S. H., Ghule, A., Chang, J. Y., Ling, Y. C.: Selective adduct formation by furan chemical ionization reagent in gas chromatography ion trap mass spectrometry. J. Mass Spectrom. 38, 401-408 (2003) (Pubitemid 36582218)
-
(2003)
Journal of Mass Spectrometry
, vol.38
, Issue.4
, pp. 401-408
-
-
Tzing, S.-H.1
Ghule, A.2
Chang, J.-Y.3
Ling, Y.-C.4
-
26
-
-
33751213044
-
On-line derivatization gas chromatography with furan chemical ionization tandem mass spectrometry for screening of amphetamines in urine
-
DOI 10.1016/j.chroma.2006.09.085, PII S0021967306018759
-
Tzing, S. H., Ghule, A., Liu, J. Y., Ling, Y. C.: On-line derivatization gas chromatography with furan chemical ionization tandem mass spectrometry for screening of amphetamines in urine. J. Chromatogr. A 1137, 76-83 (2006) (Pubitemid 44792122)
-
(2006)
Journal of Chromatography A
, vol.1137
, Issue.1
, pp. 76-83
-
-
Tzing, S.-H.1
Ghule, A.2
Liu, J.-Y.3
Ling, Y.-C.4
-
27
-
-
0037255299
-
Chemical ionization of substituted naphthalenes using tetrahydrofuran as a reagent in gas chromatography with ion trap mass spectrometry
-
DOI 10.1002/rcm.982
-
Tzing, S. H., Ghule, A., Chang, J. Y., et al.: Chemical ionization of substituted naphthalenes using tetrahydrofuran as a reagent in gas chromatography with ion trap mass spectrometry. Rapid Commun. Mass Spectrom. 17, 811-815 (2003) (Pubitemid 36433165)
-
(2003)
Rapid Communications in Mass Spectrometry
, vol.17
, Issue.8
, pp. 811-815
-
-
Tzing, S.-H.1
Ghule, A.2
Chang, J.-Y.3
Ling, Y.-C.4
-
28
-
-
0012978048
-
Mass spectrometric differentiation of isomeric polycyclic aromatic hydrocarbons by chemical ionization with diethyl ether, tetrahydrofuran and dimethyl carbonate
-
Pointet, K., Milliet, A., RenouGonnord, M. F., Fleurat Lessard, P., Levart, M.: Mass spectrometric differentiation of isomeric polycyclic aromatic hydrocarbons by chemical ionization with diethyl ether, tetrahydrofuran and dimethyl carbonate. Eur. Mass Spectrom. 3, 281-290 (1997)
-
(1997)
Eur. Mass Spectrom.
, vol.3
, pp. 281-290
-
-
Pointet, K.1
Milliet, A.2
RenouGonnord, M.F.3
Fleurat Lessard, P.4
Levart, M.5
-
29
-
-
0034044511
-
Ion/molecule reactions with dimethyl ether and dimethyl-d6 ether: Differentiation of four isomers contained in patchouli essential oil
-
DOI 10.1002/(SICI)1097-0231(20000530)14:10<872::AID-RCM958>3.0. CO;2-Z
-
Bure, C., Sellier, N., Lesage, D., Fournier, F., Tabet, J. C.: Ion-molecule reactions with dimethyl ether and dimethyl-d6 ether: Differentiation of four isomers contained in patchouli essential oil. Rapid Commun. Mass Spectrom. 14, 872-877 (2000) (Pubitemid 30367577)
-
(2000)
Rapid Communications in Mass Spectrometry
, vol.14
, Issue.10
, pp. 872-877
-
-
Bure, C.1
Sellier, N.2
Lesage, D.3
Fournier, F.4
Tabet, J.-C.5
-
30
-
-
0031172464
-
Ion-molecule reactions in the gas phase. Part XXII. Reactivity of the cis- and trans-indanediols with dimethyl ether ions
-
DOI 10.1016/S1044-0305(97)00077-9
-
Gervat, V., Fournier, F., Perlat, M. C., Tabet, J. C.: Ion-molecule reactions in the gas phase. Part xxii. Reactivity of the cis-and transindanediols with dimethyl ether ions. J. Am. Soc. Mass Spectrom. 8, 610-619 (1997) (Pubitemid 27229847)
-
(1997)
Journal of the American Society for Mass Spectrometry
, vol.8
, Issue.6
, pp. 610-619
-
-
Gervat, V.1
Fournier, F.2
Perlat, M.-C.3
Tabet, J.-C.4
-
31
-
-
0008986039
-
Novel use of crown ethers in chemical ionization mass spectrometry
-
Bose, A. K., Prakash, O., Geng, Y. H., Edasery, J.: Novel use of crown ethers in chemical ionization mass spectrometry. J. Org. Chem. 48, 1780-1782 (1983)
-
(1983)
J. Org. Chem.
, vol.48
, pp. 1780-1782
-
-
Bose, A.K.1
Prakash, O.2
Geng, Y.H.3
Edasery, J.4
-
32
-
-
73149103712
-
Ion-molecule reactions of O, S-dimethyl Methylphosphonothioate: Evidence for intramolecular sulfur oxidation during VX perhydrolysis
-
McAnoy, A. M., Williams, J., Paine, M. R. L., Rogers, M. L., Blanksby, S. J.: Ion-molecule reactions of O, S-dimethyl Methylphosphonothioate: Evidence for intramolecular sulfur oxidation during VX perhydrolysis. J. Org. Chem. 74, 9319-9327 (2009)
-
(2009)
J. Org. Chem.
, vol.74
, pp. 9319-9327
-
-
McAnoy, A.M.1
Williams, J.2
Paine, M.R.L.3
Rogers, M.L.4
Blanksby, S.J.5
-
33
-
-
34548688389
-
Selective determination of pyridine alkaloids in tobacco by PFTBA ions-analyte molecule reaction ionization ion trap mass spectrometry
-
Zhang, J. X., Ji, H. W., Sun, S. H., Mao, D. B., Liu, H. W., Guo, Y. L.: Selective determination of pyridine alkaloids in tobacco by PFTBA ions-analyte molecule reaction ionization ion trap mass spectrometry. J. Am. Soc. Mass Spectrom. 18, 1774-1782 (2007)
-
(2007)
J. Am. Soc. Mass Spectrom.
, vol.18
, pp. 1774-1782
-
-
Zhang, J.X.1
Ji, H.W.2
Sun, S.H.3
Mao, D.B.4
Liu, H.W.5
Guo, Y.L.6
-
34
-
-
33750022354
-
Application of gas chromatography-hybrid chemical ionization mass spectrometry to the analysis of diclofenac in wastewater samples
-
DOI 10.1016/j.chroma.2006.08.017, PII S0021967306015056
-
Aguera, A., Mezcua, M., Mocholi, F., Vargas-Berenguel, A., Fernandez-Alba, A. R.: Application of gas chromatography-hybrid chemical ionization mass spectrometry to the analysis of diclofenac in wastewater samples. J. Chromatogr. A 1133, 287-292 (2006) (Pubitemid 44573158)
-
(2006)
Journal of Chromatography A
, vol.1133
, Issue.1-2
, pp. 287-292
-
-
Aguera, A.1
Mezcua, M.2
Mocholi, F.3
Vargas-Berenguel, A.4
Fernandez-Alba, A.R.5
-
35
-
-
54349083798
-
Differentiation and quantification of xylene isomers by combining headspace solid-phase microextractiongas chromatography and self-ion molecule reaction in an ion trap tandem mass spectrometry
-
Yang, C. H., Khan, N. A., Wu, H. F.: Differentiation and quantification of xylene isomers by combining headspace solid-phase microextractiongas chromatography and self-ion molecule reaction in an ion trap tandem mass spectrometry. J. Sep. Sci. 31, 3050-3057 (2008)
-
(2008)
J. Sep. Sci.
, vol.31
, pp. 3050-3057
-
-
Yang, C.H.1
Khan, N.A.2
Wu, H.F.3
-
36
-
-
34249341389
-
GC/MS-positive ion chemical ionization and MS/MS study of volatile benzene compounds in five different woods used in barrel making
-
DOI 10.1002/jms.1193
-
Flamini, R., Vedova, A. D., Cancian, D., Panighel, A., Rosso, M. D.: GC/MS-positive ion chemical ionization and MS/MS study of volatile benzene compounds in five different woods used in barrel making. J. Mass Spectrom. 42, 641-646 (2007) (Pubitemid 46808486)
-
(2007)
Journal of Mass Spectrometry
, vol.42
, Issue.5
, pp. 641-646
-
-
Flamini, R.1
Dalla Vedova, A.2
Cancian, D.3
Panighel, A.4
De Rosso, M.5
-
37
-
-
32944457632
-
A validated positive chemical ionization GC/MS method for the identification and quantification of amphetamine, opiates, cocaine, and metabolites in human postmortem brain
-
DOI 10.1002/jms.975
-
Lowe, R. H., Barnes, A. J., Lehrmann, E., Freed, W. J., Kleinman, J. E., Hyde, T. M., Herman, M. M., Huestis, M. A.: A validated positive chemical ionization GC/MS method for the identification and quantification of amphetamine, opiates, cocaine, and metabolites in human postmortem brain. J. Mass Spectrom. 41, 175-184 (2006) (Pubitemid 43260158)
-
(2006)
Journal of Mass Spectrometry
, vol.41
, Issue.2
, pp. 175-184
-
-
Lowe, R.H.1
Barnes, A.J.2
Lehrmann, E.3
Freed, W.J.4
Kleinman, J.E.5
Hyde, T.M.6
Herman, M.M.7
Huestis, M.A.8
-
38
-
-
18844386296
-
Mass spectral of chloropicrin under negative ion chemical ionization conditions
-
DOI 10.1021/ac048071u
-
Murty, M. R. V. S., Prabhakar, S., Lakshmi, V. V. S., Saradhi, U. V. R. V., Reddy, T. J., Vairamani, M.: Mass spectral analysis of chloropicrin under negative ion chemical ionization conditions. Anal. Chem. 77, 3406-3410 (2005) (Pubitemid 40695504)
-
(2005)
Analytical Chemistry
, vol.77
, Issue.10
, pp. 3406-3410
-
-
Murty, M.R.V.S.1
Prabhakar, S.2
Lakshmi, V.V.S.3
Vijaya Saradhi, U.V.R.4
Jagadeshwar Reddy, T.5
Vairamani, M.6
-
39
-
-
38749097815
-
Rapid analysis of 56 pesticide residues in natural medicines by GC/MS with negative chemical ionization
-
DOI 10.1007/s11418-007-0196-x
-
Tagami, T., Kajimura, K., Satsuki, Y., Nakamura, A., Okihashi, M., Takatori, S., Kakimoto, K., Obana, H., Kitagawa, M.: Rapid analysis of 56 pesticide residues in natural medicines by GC/MS with negative chemical ionization. J. Nat. Med. 62, 126-129 (2008) (Pubitemid 351176908)
-
(2008)
Journal of Natural Medicines
, vol.62
, Issue.1
, pp. 126-129
-
-
Tagami, T.1
Kajimura, K.2
Satsuki, Y.3
Nakamura, A.4
Okihashi, M.5
Takatori, S.6
Kakimoto, K.7
Obana, H.8
Kitagawa, M.9
-
40
-
-
23844438075
-
-
Wavefunction Inc.: Irvine, CA, June 14
-
PC Spartan Pro, Version 1, 0, 7; Wavefunction Inc.: Irvine, CA, June 14, 2001.
-
(2001)
PC Spartan Pro, Version 1, 0, 7
-
-
-
41
-
-
0001100374
-
Semiempirical calculations of molecular trajectories: Method and applications to some simple molecular systems
-
Stewart, J. J. P., Davis, L. P., Burggraf, L. W.: Semiempirical calculations of molecular trajectories: Method and applications to some simple molecular systems. J. Comput. Chem. 8, 1117-1123 (1987)
-
(1987)
J. Comput. Chem.
, vol.8
, pp. 1117-1123
-
-
Stewart, J.J.P.1
Davis, L.P.2
Burggraf, L.W.3
-
42
-
-
84988129057
-
Optimization of parameters for semiempirical methods. I. Method
-
Stewart, J. J. P.: Optimization of parameters for semiempirical methods. I. Method. J. Comput. Chem. 10, 209-220 (1989)
-
(1989)
J. Comput. Chem.
, vol.10
, pp. 209-220
-
-
Stewart, J.J.P.1
-
43
-
-
84988073214
-
Optimization of parameters for semiempirical methods. II. Applications
-
Stewart, J. J. P.: Optimization of parameters for semiempirical methods. II. Applications. J. Comput. Chem. 10, 221-264 (1989)
-
(1989)
J. Comput. Chem.
, vol.10
, pp. 221-264
-
-
Stewart, J.J.P.1
-
44
-
-
84986436003
-
Calculations of molecular vibrational frequencies using semiempirical methods
-
Coolidge, M. B., Marlin, J. E., Stewart, J. J. P.: Calculations of molecular vibrational frequencies using semiempirical methods. J. Comput. Chem. 12, 948-952 (1991)
-
(1991)
J. Comput. Chem.
, vol.12
, pp. 948-952
-
-
Coolidge, M.B.1
Marlin, J.E.2
Stewart, J.J.P.3
-
45
-
-
0033471702
-
+-Cl toward cyclic organic ethers
-
DOI 10.1016/S1044-0305(99)00010-0, PII S1044030599000100
-
Ramirez-Arizmendi, L. E., Yu, Y. Q., Kenttamaa, H. I.: Reactivity of Cl-P+-Cl toward cyclic organic ethers. J. Am. Soc. Mass Spectrom. 10, 379-385 (1999) (Pubitemid 34476934)
-
(1999)
Journal of the American Society for Mass Spectrometry
, vol.10
, Issue.5
, pp. 379-385
-
-
Ramirez-Arizmendi, L.E.1
Yu, Y.Q.2
Kenttamaa, H.I.3
-
46
-
-
84855673848
-
Ionization energy determination
-
Linstrom, P. J., Mallard, W. G. eds., Gaithersburg MD;, March
-
Farmer, J. B., Henderson, I. H. S., Lossing, F. P., Marsden, D. G. H. Ionization energy determination. In: Linstrom, P. J., Mallard, W. G. (eds.) NIST Chemistry Web Book, NIST Standard Reference Database Number 69, National Institute of Standards and Technology: Gaithersburg MD; http://webbook.nist.gov (2003) March.
-
(2003)
NIST Chemistry Web Book, NIST Standard Reference Database Number
, vol.69
-
-
Farmer, J.B.1
Henderson, I.H.S.2
Lossing, F.P.3
Marsden, D.G.H.4
-
47
-
-
67349132696
-
Calculated ionization energies for a series of sesquiterpenes: Comparisons with experimental vertical ionization energies and comments on related structure-activity relationships (SARs)
-
Nauduri, D., Greenberg, A.: Calculated ionization energies for a series of sesquiterpenes: Comparisons with experimental vertical ionization energies and comments on related structure-activity relationships (SARs). Struct. Chem. 20, 417-421 (2009)
-
(2009)
Struct. Chem.
, vol.20
, pp. 417-421
-
-
Nauduri, D.1
Greenberg, A.2
|