Crystallography Open Database

Information card for entry 4349068

Preview

Coordinates	4349068.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C70 H50 N4 O16 Zn3
Calculated formula	C70 H50 N4 O16 Zn3
Title of publication	3,5-Bis((4′-carboxylbenzyl)oxy)benzoilate-based coordination polymers: their synthesis, structural characterization, and sensing properties
Authors of publication	Huang, Jing-Jing; Zhang, Xiao; Huo, Qi-Sheng; Yu, Jie-Hui; Xu, Ji-Qing
Journal of publication	Inorganic Chemistry Frontiers
Year of publication	2016
Journal volume	3
Journal issue	3
Pages of publication	406
a	45.925 ± 0.002 Å
b	6.5022 ± 0.0003 Å
c	21.3486 ± 0.0015 Å
α	90°
β	105.364 ± 0.006°
γ	90°
Cell volume	6147.2 ± 0.6 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0693
Residual factor for significantly intense reflections	0.0493
Weighted residual factors for significantly intense reflections	0.1544
Weighted residual factors for all reflections included in the refinement	0.1689
Goodness-of-fit parameter for all reflections included in the refinement	1.052
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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