DFT Study of the Catalytic Mechanism for Urethane Formation in the Presence of Basic Catalyst 1,4-Diazabicyclo[2.2.2]Octane | Communications in Computational Chemistry

DFT Study of the Catalytic Mechanism for Urethane Formation in the Presence of Basic Catalyst 1,4-Diazabicyclo[2.2.2]Octane

Authors

Zhenhao Wen, Wei Hu, Xuhui Chi, Xiaoxuan Wang, Deyu Tian, Mingliang Wang, Jianhong Liu, Xingang Ma & Aimin Pang

DOI:

https://doi.org/10.4208/cicc.2014.v2.n1.3

Keywords:

MeNCO, 2, 4‐TDI, DABCO, Urethane Formation, DFT.

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Published

2014-02-01

Issue

Vol. 2 No. 1 (2014)

Section

Articles