An experimental study of the gas-phase reaction of the NO3radical with α,β-unsaturated carbonyl compounds

2005 ◽  
Vol 7 (4) ◽  
pp. 643-650 ◽  
Author(s):  
Carlos E. Canosa-Mas ◽  
Mark L. Flugge ◽  
Martin D. King ◽  
Richard P. Wayne
2020 ◽  
Vol 755 ◽  
pp. 137757
Author(s):  
Mariela Aguilera Sammaritano ◽  
Mauro González Vera ◽  
Pablo Marcelo Cometto ◽  
Tatiane Nicola Tejero ◽  
Glauco F. Bauerfeldt ◽  
...  

2001 ◽  
Vol 7 (4-5) ◽  
pp. 343-349 ◽  
Author(s):  
D. Leblanc ◽  
J.P. Denhez ◽  
H.E. Audier

CH2=Si(CH3)OSi(CH3)2+ ions 1 were formed in the external source of a Fourier-transform ion cyclotron resonance (FT-ICR)mass spectrometer by fragmentation of (CH)3SiOSi(CH3)3. In the cell, their reactions with acetaldehyde were studied by using labeled reactants and compared with those with acetone, studied in previous work, which gives a general view of the reactions of ion 1 with carbonyl compounds. In contrast with the behavior of the corresponding carbon-containing ions, the results confirm facile 1,3-methyl group transfers from silicon to silicon. Otherwise, the silicon-containing adducts often eliminate C nH2 n. This process, not observed in (C,O,H)-containing ions, is studied by using selectively deuterated reactants.


Chemosphere ◽  
2021 ◽  
pp. 130193
Author(s):  
Asma Grira ◽  
María Antiñolo ◽  
André Canosa ◽  
Alexandre Tomas ◽  
Elena Jiménez ◽  
...  

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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