Tris(Butadiene) Compounds versus Butadiene Oligomerization in Second-Row Transition Metal Chemistry: Effects of Increased Ligand Fields

Tris(Butadiene) Compounds versus Butadiene Oligomerization in Second-Row Transition Metal Chemistry: Effects of Increased Ligand Fields

The geometries, energetics, and preferred spin states of the second-row transition metal tris(butadiene) complexes (C<sub>4</sub>H<sub>6</sub>)<sub>3</sub>M (M = Zr–Pd) and their isomers, including the experimentally known very stable molybdenum derivative (C<s...

Full description

Bibliographic Details
Main Authors: Yi Zhao, Qun Chen, Mingyang He, Zhihui Zhang, Xuejun Feng, Yaoming Xie, Robert Bruce King, Henry F. Schaefer
Format: Article
Language:English
Published: MDPI AG 2021-04-01
Series:Molecules
Subjects:
butadiene complexes
transition metals
density functional theory
Online Access:https://www.mdpi.com/1420-3049/26/8/2220

Internet

https://www.mdpi.com/1420-3049/26/8/2220

Similar Items