Crystallography Open Database





Information card for 7205951

7205950 << 7205951 >> 7205952

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Coordinates

7205951.cif

Structure parameters

Formula - C4 H7 Cd I N2 O S2 -
Calculated formula - C4 H7 Cd I N2 O S2 -
Title of publication New organically decorated cadmium halides incorporating the second or the third inorganic anionic groups
Authors of publication Jin, Juan; Jia, Ming-Jun; Peng, Yu; Yu, Jie-Hui; Xu, Ji-Qing
Journal of publication CrystEngComm
Year of publication 2011
Journal volume 13
Journal issue 8
Pages of publication 2942
a 4.2002 ± 0.0008 Å
b 20.158 ± 0.004 Å
c 12.441 ± 0.003 Å
α 90°
β 96.58 ± 0.03°
γ 90°
Cell volume 1046.4 ± 0.4 Å3
Cell temperature 293 ± 2 K
Ambient diffraction temperature 293 ± 2 K
Number of distinct elements 7
Hermann-Mauguin symmetry space group P 1 21/c 1
Hall symmetry space group -P 2ybc
Residual factor for all reflections 0.0254
Residual factor for observed reflections 0.0211
Weighted residual factors for the observed reflections 0.0412
Weighted residual factors for all reflections included in the refinement 0.0423
Goodness-of-fit parameter for observed reflections 1.038
Diffraction radiation wavelength 0.71073 Å
Diffraction radiation type MoKα
Has coordinates Yes
Has disorder No
Has Fobs No

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