Distinctive C–N cleavage/C–C formation mechanism in Au-catalyzed reactions of N-(o-alkynylphenyl)imines and vinyldiazo ketones DOI
Yuxia Liu, Jing Zhang,

Qingqing Qu

et al.

Catalysis Science & Technology, Journal Year: 2024, Volume and Issue: unknown

Published: Dec. 23, 2024

A distinctive C–N cleavage/C–C bonding mechanism was theoretically revealed for Au-catalyzed reactions of N -( o -alkynylphenyl)imines with vinyldiazo ketones.

Language: Английский

Revisiting a classic carbocation – DFT, coupled-cluster, and ab initio molecular dynamics computations on barbaralyl cation formation and rearrangements DOI Creative Commons
Wentao Guo, Wang‐Yeuk Kong, Dean J. Tantillo

et al.

Chemical Science, Journal Year: 2024, Volume and Issue: 15(38), P. 15577 - 15587

Published: Jan. 1, 2024

Computations were used to model the rearrangement of barbaralyl cation, a structure that demonstrates nonclassical bridging, homoconjugation, fluxionality, non-statistical dynamic effects, post-transition state bifurcations, and tunneling!

Language: Английский

Citations

0
Distinctive C–N cleavage/C–C formation mechanism in Au-catalyzed reactions of N-(o-alkynylphenyl)imines and vinyldiazo ketones DOI
Yuxia Liu, Jing Zhang,

Qingqing Qu

et al.

Catalysis Science & Technology, Journal Year: 2024, Volume and Issue: unknown

Published: Dec. 23, 2024

A distinctive C–N cleavage/C–C bonding mechanism was theoretically revealed for Au-catalyzed reactions of N -( o -alkynylphenyl)imines with vinyldiazo ketones.

Language: Английский

Citations

0