首页
按分类浏览
期刊浏览
卷期浏览
Crystal, Molecular and Electronic Structure of the Electron Acceptor 2,5-difluoro-7,7,8...
|
Crystal, Molecular and Electronic Structure of the Electron Acceptor 2,5-difluoro-7,7,8,8-Tetracyano-p-quinodimethane, 2,5-TCNQF2
作者:
F. Mitchell Wiygul,
JohnP. Ferraris,
ThomasJ. Emge,
ThomasJ. Kistenmacher,
期刊:
Molecular Crystals and Liquid Crystals
(Taylor Available online 1981)
卷期:
Volume 78,
issue 1
页码: 279-293
ISSN:0026-8941
年代: 1981
DOI:10.1080/00268948108082165
出版商: Taylor & Francis Group
数据来源: Taylor
摘要:
The crystal structure of the electron acceptor 2,5-difluoro-7,7,8,8-tetracyano-p-quinodimethane, 2,5-TCNQF2, has been determined by single-crystal X-ray diffraction methods. The layered crystal structure is dominated by the antiparallel coupling of cyano bond moments of symmetry-related molecules. The molecular and electronic structure (INDO approximation) of 2,5-TCNQF2 are extensively compared to that of its parent TCNQ and the perfluoro analog TCNQF4. Crystal data for 2,5-TCNQF2 are as follow: monoclinic, space group C2/m, a=10.208(4) Å, b=6.026(2) Å, c=8.836(3) Å,β=106.64(3)[ddot], V=520.8 Å3. The site symmetry (2/m;C2h) in the crystal is identical to that for the free 2,5-TCNQF2 molecule
点击下载:
PDF (578KB)
返 回
|
|