Crystallography Open Database





Information card for 7206032

7206031 << 7206032 >> 7206033

Preview



Coordinates

7206032.cif

Structure parameters

Formula - C16 H22 Cu I3 N2 -
Calculated formula - C16 H22 Cu I3 N2 -
Title of publication Dielectric anisotropy of the single crystal of isopropylviologen copper(i) triiodide.
Authors of publication Chen, Yang; Yang, Zhou; Wu, Xin-Yi; Ni, Chun-Yan; Ren, Zhi-Gang; Lang, Jian-Ping
Journal of publication Physical chemistry chemical physics : PCCP
Year of publication 2011
Journal volume 13
Journal issue 22
Pages of publication 10781 - 10786
a 12.469 ± 0.003 Å
b 11.529 ± 0.002 Å
c 14.906 ± 0.003 Å
α 90°
β 91.38 ± 0.03°
γ 90°
Cell volume 2142.2 ± 0.8 Å3
Cell temperature 223 ± 2 K
Ambient diffraction temperature 223 ± 2 K
Number of distinct elements 5
Hermann-Mauguin symmetry space group P 1 21/c 1
Hall symmetry space group -P 2ybc
Residual factor for all reflections 0.0844
Residual factor for observed reflections 0.0596
Weighted residual factors for the observed reflections 0.137
Weighted residual factors for all reflections included in the refinement 0.1539
Goodness-of-fit parameter for observed reflections 1.096
Diffraction radiation wavelength 0.71073 Å
Diffraction radiation type MoKα
Has coordinates Yes
Has disorder Yes
Has Fobs No

Top of the page