A quantum-chemical study on the structures of linear conjugated systems that absorb in the near IR range

1999 ◽  
Vol 35 (3) ◽  
pp. 142-145 ◽  
Author(s):  
Yu. N. Bernatskaya ◽  
A. D. Kachkovskii
Keyword(s):  
Quantum Chemical ◽  
Quantum Chemical Study ◽  
Chemical Study ◽  
Conjugated Systems ◽  
Near Ir ◽  
Linear Conjugated Systems ◽  
Near Ir Range

Sigmatropic proton shifts: a quantum chemical study

2017 ◽  
Vol 15 (35) ◽  
pp. 7439-7446 ◽  
Author(s):  
Yi Wang ◽  
Zhi-Xiang Yu
Keyword(s):  
Quantum Chemical Calculations ◽  
Quantum Chemical ◽  
Quantum Chemical Study ◽  
Chemical Study ◽  
Conjugated Systems

Insights into [1,j] sigmatropic proton shifts in polyenyl anions and related conjugated systems have been revealed by quantum chemical calculations.

A quantum chemical study of the acidity of acetylene and 1,2-dihydrobuckminsterfullerene de-rivatives

2018 ◽  
Vol 59 (1) ◽  
pp. 51-53
Author(s):  
M. V. Makarova ◽  
◽  
S. G. Semenov ◽  
R. R. Kostikov ◽  
◽  
...  
Keyword(s):  
Quantum Chemical ◽  
Quantum Chemical Study ◽  
Chemical Study
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