Gas-phase reaction of benzothiophene with hydrogen atoms

1979 ◽  
Vol 44 (19) ◽  
pp. 3321-3323 ◽  
Author(s):  
Nguyen Hieu Hanh ◽  
Junya Nishino ◽  
Muneyoshi Yamada ◽  
Osamu Horie ◽  
Akira Amano
1980 ◽  
Vol 11 (4) ◽  
Author(s):  
N. H. HANH ◽  
J. NISHINO ◽  
M. YAMADA ◽  
O. HORIE ◽  
A. AMANO

1971 ◽  
Vol 49 (5) ◽  
pp. 803-806 ◽  
Author(s):  
Nick Demchuk ◽  
H. D. Gesser

The gas phase reaction of hydrogen atoms with carbon suboxide was studied over the temperature range of−96 to 235 °C and was found to proceed via a chain reaction. The products found were CH4, CO, CH2CO, C2H6, (CHO)2, and polymer. A mechanism is proposed and the chain reaction is explained by the intermediate formation of ketene and the formyl radical.


2019 ◽  
Author(s):  
Javad Noroozi ◽  
William Smith

We use molecular dynamics free energy simulations in conjunction with quantum chemical calculations of gas phase reaction free energy to predict alkanolamines pka values. <br>


2021 ◽  
Vol 330 ◽  
pp. 125002
Author(s):  
Yan-Yu Chen ◽  
Yuki Soma ◽  
Masahito Ishikawa ◽  
Masatomo Takahashi ◽  
Yoshihiro Izumi ◽  
...  

ACS Omega ◽  
2021 ◽  
Vol 6 (3) ◽  
pp. 2410-2419
Author(s):  
Junyao Li ◽  
Narcisse T. Tsona ◽  
Shanshan Tang ◽  
Xiuhui Zhang ◽  
Lin Du

1989 ◽  
Vol 24 (10) ◽  
pp. 3679-3685 ◽  
Author(s):  
C. H. Pai ◽  
K. Koumoto ◽  
S. Takeda ◽  
H. Yanagida

2007 ◽  
Vol 44 (6) ◽  
pp. 447-452 ◽  
Author(s):  
Akira Watanabe ◽  
Motoharu Fujii ◽  
Masayoshi Kawahara ◽  
Takehisa Fukui ◽  
Kiyoshi Nogi

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