Crystallography Open Database





Information card for 7205983

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Coordinates

7205983.cif

Structure parameters

Formula - C36 H38 Hg2 I3 N4 O4.5 -
Calculated formula - C36 H37 Hg2 I3 N4 O4.5 -
Title of publication Mercury(ii), copper(ii) and silver(i) complexes with ether or diether functionalized bis-NHC ligands: synthesis and structural studies
Authors of publication Liu, Qing-Xiang; Yu, Jie; Zhao, Xiao-Jun; Liu, Shu-Weng; Yang, Xiao-Qiong; Li, Kang-Ying; Wang, Xiu-Guang
Journal of publication CrystEngComm
Year of publication 2011
Journal volume 13
Journal issue 12
Pages of publication 4086
a 11.51 ± 0.002 Å
b 11.811 ± 0.002 Å
c 15.423 ± 0.003 Å
α 84.823 ± 0.003°
β 87.271 ± 0.003°
γ 81.578 ± 0.003°
Cell volume 2064.3 ± 0.6 Å3
Cell temperature 296 ± 2 K
Ambient diffraction temperature 296 ± 2 K
Number of distinct elements 6
Hermann-Mauguin symmetry space group P -1
Hall symmetry space group -P 1
Residual factor for all reflections 0.0801
Residual factor for observed reflections 0.0618
Weighted residual factors for the observed reflections 0.1653
Weighted residual factors for all reflections included in the refinement 0.1789
Goodness-of-fit parameter for observed reflections 1.028
Diffraction radiation wavelength 0.71073 Å
Diffraction radiation type MoKα
Has coordinates Yes
Has disorder No
Has Fobs No

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