Crystallography Open Database

Information card for entry 7029429

Preview

Coordinates	7029429.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C8 H12 Cd N6 S4
Calculated formula	C8 H12 Cd N6 S4
Title of publication	New hybrid Cd(ii) compounds: synthesis and structural characterization.
Authors of publication	Jia, Hong-Li; Shi, Zhan; Yang, Qing-Feng; Yu, Jie-Hui; Xu, Ji-Qing
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2014
Journal volume	43
Journal issue	15
Pages of publication	5806 - 5814
a	6.1287 ± 0.0004 Å
b	10.5689 ± 0.0007 Å
c	11.8829 ± 0.0007 Å
α	90°
β	98.756 ± 0.004°
γ	90°
Cell volume	760.73 ± 0.08 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0321
Residual factor for significantly intense reflections	0.0305
Weighted residual factors for significantly intense reflections	0.07
Weighted residual factors for all reflections included in the refinement	0.071
Goodness-of-fit parameter for all reflections included in the refinement	1.193
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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