Crystallography Open Database

Information card for entry 7035146

Preview

Coordinates	7035146.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H26 Br4 Cd N12 O5 S5
Calculated formula	C24 H24 Br4 Cd N12 O5 S5
Title of publication	New organically templated thiocyanatocadmates and chlorocuprate(ii): synthesis and structural characterization.
Authors of publication	Guo, Bing; Zhang, Xiao; Yu, Jie-Hui; Xu, Ji-Qing
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2015
Journal volume	44
Journal issue	25
Pages of publication	11470 - 11481
a	9.9159 ± 0.0004 Å
b	12.9791 ± 0.0008 Å
c	16.8359 ± 0.0008 Å
α	68.545 ± 0.003°
β	88.854 ± 0.003°
γ	79.115 ± 0.004°
Cell volume	1977.49 ± 0.18 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0745
Residual factor for significantly intense reflections	0.0603
Weighted residual factors for significantly intense reflections	0.1789
Weighted residual factors for all reflections included in the refinement	0.1893
Goodness-of-fit parameter for all reflections included in the refinement	1.084
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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