Crystallography Open Database

Information card for entry 7054964

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Coordinates	7054964.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H14 N3 O4 S Zn
Calculated formula	C22 H14 N3 O4 S Zn
Title of publication	Structural diversification and photocatalytic properties of zinc(ii) polymers modified by auxiliary N-containing ligands
Authors of publication	Yin, Wen-Yu; Huang, Zuo-Long; Tang, Xiao-Yan; Wang, Jun; Cheng, Hong-Jian; Ma, Yun-Sheng; Yuan, Rong-Xin; Liu, Dong
Journal of publication	New J. Chem.
Year of publication	2015
Journal volume	39
Journal issue	9
Pages of publication	7130
a	20.434 ± 0.004 Å
b	9.921 ± 0.002 Å
c	14.065 ± 0.003 Å
α	90°
β	133.25 ± 0.03°
γ	90°
Cell volume	2076.8 ± 1.3 Å³
Cell temperature	291 ± 2 K
Ambient diffraction temperature	291 ± 2 K
Number of distinct elements	6
Space group number	5
Hermann-Mauguin space group symbol	C 1 2 1
Hall space group symbol	C 2y
Residual factor for all reflections	0.0691
Residual factor for significantly intense reflections	0.0561
Weighted residual factors for significantly intense reflections	0.1207
Weighted residual factors for all reflections included in the refinement	0.1263
Goodness-of-fit parameter for all reflections included in the refinement	1.096
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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