Conformational analysis with both experimental and computational data for both gaseous and crystalline phases: unexpected interactions in N-methyldichloroacetamide
(2004)
Journal Article
Hinchley, S., Robertson, H., McLachlan, L., Morrison, C., Rankin, D., Simpson, S., & Thomas, E. (2004). Conformational analysis with both experimental and computational data for both gaseous and crystalline phases: unexpected interactions in N-methyldichloroacetamide. https://doi.org/10.1021/jp036478h
The structure of N-methyldichloroacetamide (MeNHCOCHCl2) has been elucidated in the gaseous and solid states experimentally by gas electron diffraction and X-ray crystallography, and computationally with ab initio and plane-wave DFT methods. Although... Read More about Conformational analysis with both experimental and computational data for both gaseous and crystalline phases: unexpected interactions in N-methyldichloroacetamide.