Mechanism(s) of thermal decomposition of N-Nitrosoamides: A density functional theory study

Tetrahedron ◽  
2019 ◽  
Vol 75 (8) ◽  
pp. 929-935 ◽  
Author(s):  
Oriana Brea ◽  
Henrik Daver ◽  
Julius Rebek ◽  
Fahmi Himo
Keyword(s):  
Density Functional Theory ◽  
Thermal Decomposition ◽  
Density Functional ◽  
Density Functional Theory Study ◽  
Functional Theory

Mechanism of the thermal decomposition of tetramethylsilane: a flash pyrolysis vacuum ultraviolet photoionization time-of-flight mass spectrometry and density functional theory study

2018 ◽  
Vol 20 (27) ◽  
pp. 18782-18789 ◽  
Author(s):  
Xinghua Liu ◽  
Jingsong Zhang ◽  
Alexis Vazquez ◽  
Daxi Wang ◽  
Shuyuan Li
Keyword(s):  
Mass Spectrometry ◽  
Density Functional Theory ◽  
Thermal Decomposition ◽  
Density Functional ◽  
Vacuum Ultraviolet ◽  
Time Of Flight ◽  
Density Functional Theory Study ◽  
Functional Theory ◽  
Flash Pyrolysis ◽  
Flight Mass Spectrometry

Silene/silyene conversion via 1,2-shift plays an important role in H2 elimination in the process of the thermal decomposition of tetramethylsilane.

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