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Information card for 7205981

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Coordinates

7205981.cif

Structure parameters

Formula - C30 H46 Cu Hg I4 N4 O3 S2 -
Calculated formula - C30 H46 Cu Hg I4 N4 O3 S2 -
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 20.465 ± 0.006 Å
b 11.488 ± 0.004 Å
c 19.833 ± 0.009 Å
α 90°
β 115.192 ± 0.004°
γ 90°
Cell volume 4219 ± 3 Å3
Cell temperature 296 ± 2 K
Ambient diffraction temperature 296 ± 2 K
Number of distinct elements 8
Hermann-Mauguin symmetry space group C 1 2/c 1
Hall symmetry space group -C 2yc
Residual factor for all reflections 0.1232
Residual factor for observed reflections 0.0753
Weighted residual factors for the observed reflections 0.1843
Weighted residual factors for all reflections included in the refinement 0.2161
Goodness-of-fit parameter for observed reflections 1.059
Diffraction radiation wavelength 0.71073 Å
Diffraction radiation type MoKα
Has coordinates Yes
Has disorder No
Has Fobs No

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