Unimolecular reactions of the enolic tautomer of ionized acetic acid in the gas phase: an ab initio and RRKM study

1988 ◽  
Vol 92 (12) ◽  
pp. 3336-3341 ◽  
Author(s):  
Rosa Caballol ◽  
Josep M. Poblet ◽  
Jose Pedro Sarasa ◽  
Santiago Olivella ◽  
Albert Sole
Keyword(s):  
Acetic Acid ◽  
Ab Initio ◽  
Gas Phase ◽  
Unimolecular Reactions

Potential energy profile for gas-phase, unimolecular reactions of ionized acetic acid and its enol. The barrier to a 1,3-hydrogen migration

1978 ◽  
Vol 100 (22) ◽  
pp. 7052-7055 ◽  
Author(s):  
Helmut Schwarz ◽  
Dudley H. Williams ◽  
Chrysostomos Wesdemiotis
Keyword(s):  
Acetic Acid ◽  
Potential Energy ◽  
Gas Phase ◽  
Energy Profile ◽  
Potential Energy Profile ◽  
Unimolecular Reactions ◽  
Hydrogen Migration

ChemInform Abstract: THERMOCHEMISTRY AND UNIMOLECULAR REACTIONS OF IONIZED ACETIC ACID AND ITS ENOL IN THE GAS PHASE

1980 ◽  
Vol 11 (34) ◽  
Author(s):  
J. L. HOLMES ◽  
F. P. LOSSING
Keyword(s):  
Acetic Acid ◽  
Gas Phase ◽  
Unimolecular Reactions

Photodissociation of Acetic Acid in the Gas Phase:  An ab Initio Study

2002 ◽  
Vol 67 (24) ◽  
pp. 8407-8415 ◽  
Author(s):  
Wei-Hai Fang ◽  
Ruo-Zhuang Liu ◽  
Xuming Zheng ◽  
David Lee Phillips
Keyword(s):  
Acetic Acid ◽  
Ab Initio ◽  
Gas Phase ◽  
Ab Initio Study

Thermochemistry and unimolecular reactions of ionized acetic acid and its enol in the gas phase

1980 ◽  
Vol 102 (11) ◽  
pp. 3732-3735 ◽  
Author(s):  
John L. Holmes ◽  
F. P. Lossing
Keyword(s):  
Acetic Acid ◽  
Gas Phase ◽  
Unimolecular Reactions

Ab Initio Calculations on Sequential Reactions of Nitric Oxide with Titanium Ions in the Gas Phase

2020 ◽  
Vol 124 (25) ◽  
pp. 5194-5203
Author(s):  
Zahra Safaei ◽  
Alireza Shayesteh
Keyword(s):  
Nitric Oxide ◽  
Ab Initio Calculations ◽  
Ab Initio ◽  
Gas Phase ◽  
Sequential Reactions

Ab initio prediction of gas phase molecular structure of 1-chlorsilatrane

1995 ◽  
Author(s):  
Gábor I. Csonka ◽  
Pál Hencsei
Keyword(s):  
Molecular Structure ◽  
Ab Initio ◽  
Gas Phase ◽  
Ab Initio Prediction

Ab Initio Study of the Carbon-to-Carbon Identity Proton Transfer from Ketene to Its Anion in the Gas Phase

2001 ◽  
Vol 123 (10) ◽  
pp. 2430-2431 ◽  
Author(s):  
Claude F. Bernasconi ◽  
Philip J. Wenzel
Keyword(s):  
Proton Transfer ◽  
Ab Initio ◽  
Gas Phase ◽  
Ab Initio Study
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