𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Experimental and Theoretical Study on the Structure and Formation Mechanism of [C 6 H 5 Cu m ] - ( m = 1−3)

✍ Scribed by Liu, Xiao-Jing; Zhang, Xiang; Han, Ke-Li; Xing, Xiao-peng; Sun, Shu-tao; Tang, Zi-Chao

Book ID
126051831
Publisher
American Chemical Society
Year
2007
Tongue
English
Weight
365 KB
Volume
111
Category
Article
ISSN
1089-5639

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Theoretical study on the structure and f
Theoretical study on the structure and formation mechanism of [C6H5Mm]− (MAg, Au; m = 1–3)
✍ Xiao-Jing Liu; Chuan-Lu Yang; Xiang Zhang; Ke-Li Han; Zi-Chao Tang 📂 Article 📅 2008 🏛 John Wiley and Sons 🌐 English ⚖ 627 KB

## Abstract The structures and formation mechanisms of the important intermediate phenyl‐coinage metal complexes [C~6~H~5~M~__m__~]^−^ (MAg, Au, __m__ = 1–3) are investigated at B3LYP//6‐311G(d, p)/Lanl2dz level using Gaussian 03 program. The adiabatic electron affinity and vertical dissociation e

A theoretical and experimental study of
A theoretical and experimental study of the structures and stabilities of the [C5H3]+ cation
✍ Barbara M. Kompe; J. Barrie Peel; John C. Traeger 📂 Article 📅 1993 🏛 John Wiley and Sons 🌐 English ⚖ 846 KB

The structures and energies for 16 different [ C,H, 1 + isomers were geometry optimized from ab initio molecular orbital calculations. The global minimum on the [ C,H,] + surface at the MP3/6-31G\* level was found to be the ethynyl cyclopropenylium cation (a), with a penta-1,Miynylium structure (b)