Crystallography Open Database

Information card for entry 1561617

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Coordinates	1561617.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H19 Cd1.5 N4 O10 S
Calculated formula	C20 H19 Cd1.5 N4 O10 S
Title of publication	Structural diversity and fluorescence properties of three 2-sulfoterephthalate CdII/ZnII coordination polymers employing 1,4-bisbenzimidazole
Authors of publication	Ren, Yixia; Chai, Hongmei; Tang, Long; Hou, Xiangyang; Wang, Jijiang
Journal of publication	Journal of Solid State Chemistry
Year of publication	2016
Journal volume	234
Pages of publication	103 - 109
a	14.373 ± 0.002 Å
b	38.22 ± 0.005 Å
c	9.0099 ± 0.0012 Å
α	90°
β	90°
γ	90°
Cell volume	4949.5 ± 1.2 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	41
Hermann-Mauguin space group symbol	A e a 2
Hall space group symbol	A 2 -2ab
Residual factor for all reflections	0.0208
Residual factor for significantly intense reflections	0.0184
Weighted residual factors for significantly intense reflections	0.047
Weighted residual factors for all reflections included in the refinement	0.0573
Goodness-of-fit parameter for all reflections included in the refinement	1.127
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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