Interactions between Functional Groups. Part I. Crystal Structure of 2‐Phenylethynyl‐N,N‐dimthlaniline at 98 K: A Remarkably Short CH …︁ C Distance
作者:
John D. Wallis,
Jack D. Dunitz,
期刊:
Helvetica Chimica Acta
(WILEY Available online 1984)
卷期:
Volume 67,
issue 1
页码: 39-46
ISSN:0018-019X
年代: 1984
DOI:10.1002/hlca.19840670106
出版商: WILEY‐VCH Verlag GmbH
数据来源: WILEY
摘要:
AbstractIn the crystal structure of the title compound at 98 K the dimethylamino group has pyramidal geometry. The nitrogenlone pair is not directed towards the triple bond; instead, one NCH3bond lies almost in the plane of the disubstituted ring, directed away from the triple bond, while the other NCH3bond and the lone pair are directed to opposite sides of the plane, nearer to the acetylene. There is a remarkably short intramolecular contact (2.39 Å) between a methyl H‐ and an acetylenic C‐atom. TheTaftσIparameter of the arylethynyl substituent appears to be similar to that of a carboxylic ester, judging from the bond‐angle deformation at the
点击下载:
PDF
(429KB)
返 回