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Peräkylä, Mikael (1996) Proton Abstraction from Carbon Acids.AbInitioMolecular Orbital Study on the Proton Abstraction from Acetaldehyde by NH2-, OH-, F-, SiH3-, PH2-, and SH-. The Journal of Physical Chemistry, 100 (9). 3441-3447 doi:10.1021/jp9517211

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Reference TypeJournal (article/letter/editorial)
TitleProton Abstraction from Carbon Acids.AbInitioMolecular Orbital Study on the Proton Abstraction from Acetaldehyde by NH2-, OH-, F-, SiH3-, PH2-, and SH-
JournalThe Journal of Physical Chemistry
AuthorsPeräkylä, MikaelAuthor
Year1996 (January)Volume100
Issue9
PublisherAmerican Chemical Society (ACS)
DOIdoi:10.1021/jp9517211Search in ResearchGate
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Mindat Ref. ID8045530Long-form Identifiermindat:1:5:8045530:3
GUID0
Full ReferencePeräkylä, Mikael (1996) Proton Abstraction from Carbon Acids.AbInitioMolecular Orbital Study on the Proton Abstraction from Acetaldehyde by NH2-, OH-, F-, SiH3-, PH2-, and SH-. The Journal of Physical Chemistry, 100 (9). 3441-3447 doi:10.1021/jp9517211
Plain TextPeräkylä, Mikael (1996) Proton Abstraction from Carbon Acids.AbInitioMolecular Orbital Study on the Proton Abstraction from Acetaldehyde by NH2-, OH-, F-, SiH3-, PH2-, and SH-. The Journal of Physical Chemistry, 100 (9). 3441-3447 doi:10.1021/jp9517211
In(1996, January) The Journal of Physical Chemistry Vol. 100 (9) American Chemical Society (ACS)

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Peräkylä, Mikael (1999) Ab initio quantum mechanical calculations of p Kas of isolated molecules and molecules undergoing chemical reactions: p Ka of acetic acid during α-proton abstraction. Physical Chemistry Chemical Physics, 1 (24). 5643-5647 doi:10.1039/a907913k
Xie, Ju, Feng, Dacheng, Feng, Shengyu, Zhang, Jie (2005) Theoretical study on insertion of silylenoid H2SiLiF into X–H bonds (X=CH3, SiH3, NH2, PH2, OH, SH and F). Journal of Molecular Structure: THEOCHEM, 755. 55-63 doi:10.1016/j.theochem.2005.07.027
Bernasconi, Claude F., Wenzel, Philip J. (1996) Transition State Imbalances in Gas Phase Proton Transfers.Ab InitioStudy of the Carbon-to-Carbon Proton Transfer from the Protonated Acetaldehyde Cation to Acetaldehyde Enol. Journal Of The American Chemical Society, 118 (43) 10494-10504 doi:10.1021/ja960233j
Vohs, J. M., Barteau, M. A. (1987) Structure sensitivity and selectivity of proton abstraction from alkynes on the polar faces of zinc oxide. The Journal of Physical Chemistry, 91 (18). 4766-4776 doi:10.1021/j100302a025
Hupe, D. J., Pohl, E. R. (1984) On the magnitude of primary isotope effects for proton abstraction from carbon. Journal Of The American Chemical Society, 106 (19) 5634-5640 doi:10.1021/ja00331a038
Bauschlicher, Charles W., Papajak, Ewa, Haskins, Justin B., Lawson, John W. (2019) Proton Abstraction from DMEn···X+ by OH–, O2–, and XO2–, for X = Li, Na, and K: Implications for Li–O2 Batteries. The Journal of Physical Chemistry A, 123 (23). 4942-4947 doi:10.1021/acs.jpca.9b03804
Srinivasulu, G., Rajakumar, B. (2013) Theoretical Investigations on the Kinetics of H-Abstraction Reactions from CF3CH(OH)CF3 by OH Radicals. The Journal of Physical Chemistry A, 117 (22). 4534-4544 doi:10.1021/jp4006907
Leroy, G, Dewispelaere, J.-P, Wilante, C (1998) A theoretical approach to the thermochemistry of the isomerization reactions CH2XCHYCH3⇌CH2YCHXCH3 (X=OH, Y=PH2, CH3, SH, NH2, Cl; X=Cl, Y=PH2, SH, NH2; X=NH2, Y=PH2, SH; X=SH, Y=PH2). Journal of Molecular Structure: THEOCHEM, 433. 239-245 doi:10.1016/s0166-1280(98)00030-x
Cram, Donald J., Rickborn, Bruce, Knox, Graham R. (1960) EFFECT OF SOLVENT ON RATE OF BASE-CATALYZED PROTON ABSTRACTION FROM CARBON. Journal Of The American Chemical Society, 82 (24) 6412-6413 doi:10.1021/ja01509a055
Pohl, Eric R., Hupe, D. J. (1978) Solvation as the cause for slower rates of cyanide and thiol anion catalyzed proton abstraction from carbon compared to oxy anions of the same basicity. Journal Of The American Chemical Society, 100 (26) 8130-8133 doi:10.1021/ja00494a018
Mousavipour, S. Hosein, Pacey, Philip D. (1996) Initiation and Abstraction Reactions in the Pyrolysis of Acetone. The Journal of Physical Chemistry, 100 (9). 3573-3579 doi:10.1021/jp9520613
 
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