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Poirier, Raymond A., Yu, Dake, Surjan, Peter R. (1991) An ab initio study of the H2O-mediated 1,3-hydrogen rearrangement in the isoelectric series: X, Y = CH2, NH, or O. Canadian Journal of Chemistry, 69 (10). 1589-1599 doi:10.1139/v91-234

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Reference TypeJournal (article/letter/editorial)
TitleAn ab initio study of the H2O-mediated 1,3-hydrogen rearrangement in the isoelectric series: X, Y = CH2, NH, or O
JournalCanadian Journal of Chemistry
AuthorsPoirier, Raymond A.Author
Yu, DakeAuthor
Surjan, Peter R.Author
Year1991 (October 1)Volume69
Issue10
PublisherCanadian Science Publishing
DOIdoi:10.1139/v91-234Search in ResearchGate
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Mindat Ref. ID8317589Long-form Identifiermindat:1:5:8317589:7
GUID0
Full ReferencePoirier, Raymond A., Yu, Dake, Surjan, Peter R. (1991) An ab initio study of the H2O-mediated 1,3-hydrogen rearrangement in the isoelectric series: X, Y = CH2, NH, or O. Canadian Journal of Chemistry, 69 (10). 1589-1599 doi:10.1139/v91-234
Plain TextPoirier, Raymond A., Yu, Dake, Surjan, Peter R. (1991) An ab initio study of the H2O-mediated 1,3-hydrogen rearrangement in the isoelectric series: X, Y = CH2, NH, or O. Canadian Journal of Chemistry, 69 (10). 1589-1599 doi:10.1139/v91-234
In(1991, October) Canadian Journal of Chemistry Vol. 69 (10) Canadian Science Publishing

See Also

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Yu, Dake, Poirier, Raymond A., Surjan, Peter R. (1991) Interaction energies between H2O and HX—CH=Y/X=CH—YH for X, Y=CH2, NH or O — the chemical Hamiltonian approach. Chemical Physics Letters, 183. 25-30 doi:10.1016/0009-2614(91)85093-c
Poirier, Raymond A., Majlessi, Dariush, Zielinski, Theresa J. (1986) An SCF and CI Study of the 1,3 Shift in the HX?CH?Y?X?CH?YH Isoelectronic Series: X, Y?CH2, NH, and O. Journal of Computational Chemistry, 7 (4). 464-475 doi:10.1002/jcc.540070409
Ríos, Miguel A., Rodríguez, Jesús (1991) An ab initio study of the structure and intramolecular proton transfer in tropolone. Canadian Journal of Chemistry, 69 (2). 201-204 doi:10.1139/v91-032
Pye, Cory C, Poirier, Raymond A (2005) An ab initio study of 1,5-suprafacial shifts in 5-substituted 1,3-cyclopentadienes. Canadian Journal of Chemistry, 83 (9). 1299-1305 doi:10.1139/v05-141
Del Bene, Janet E., Kim, Kyungsun, Shavitt, Isaiah (1991) An ab initio study of symmetry breaking in calculations on the first excited singlet state of N2H2. Canadian Journal of Chemistry, 69 (2). 246-250 doi:10.1139/v91-039
Poirier, Raymond A., Yadav, Arpita, Surján, Péter R. (1987) Effect of protonation on the ground state properties of retinal analogs: an ab-initio study. Canadian Journal of Chemistry, 65 (4). 892-897 doi:10.1139/v87-150
Pye, Cory C, Xidos, James D, Burnell, D Jean, Poirier, Raymond A (2003) An ab initio study of conformations and IR spectra of 5-substituted 1,3-cyclopentadienes. Canadian Journal of Chemistry, 81 (1). 14-30 doi:10.1139/v02-192
Mak, Melody L, Salpietro, Salvatore J, Enriz, R Daniel, Csizmadia, Imre G (2000) An exploratory ab initio study on the conformations of ethylguanidine in its neutral [CH3-CH2-NH-C(=NH)NH2] and protonated [CH3-CH2-NH-C(NH2)2] forms. Canadian Journal of Chemistry, 78 (5). 626-641 doi:10.1139/v00-065
Ellis, Susan, Livingstone, Edward G., Westwood, Nicholas P. C. (1991) Ab initio studies of isocyanatoborane and difluoroisocyanatoborane; bent or linear BNCO chains?. Canadian Journal of Chemistry, 69 (6). 1000-1005 doi:10.1139/v91-146
Chow, Yuan L., Cheng, Xianen (1991) The dual pathway in photocycloaddition of 1,3-diketonatoboron difluorides: excimer reactions. Canadian Journal of Chemistry, 69 (10). 1575-1583 doi:10.1139/v91-232
Chow, Y. L., Cheng, Xianen (1991) 1,3-Diketonatoboron difluoride sensitized cation radical reactions. Canadian Journal of Chemistry, 69 (8). 1331-1336 doi:10.1139/v91-198
 
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