Novel intermolecular C-H pi interactions: An ab initio and density functional theory study
The recent characterisation of short contacts between chloroform solvate molecules and the C-C triple bond of gold ethynides has prompted a theoretical investigation of the strength of C-H ⋯ π interactions. Extensive ab initio and density functional theory calculations have been performed on a varie...
| Үндсэн зохиолчид: | , , , |
|---|---|
| Формат: | Journal article |
| Хэл сонгох: | English |
| Хэвлэсэн: |
1996
|