Crystallography Open Database

Information card for entry 7231493

Preview

Coordinates	7231493.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H30 Cd3 N4 O16
Calculated formula	C38 H30 Cd3 N4 O16
Title of publication	Five transition metal coordination polymers driven by a semirigid trifunctional nicotinic acid ligand: selective adsorption and magnetic properties
Authors of publication	Bai, Nannan; Gao, Ruicheng; Wang, Haihua; Wu, Yunlong; Hou, Lei; Wang, Yao-Yu
Journal of publication	CrystEngComm
Year of publication	2018
Journal volume	20
Journal issue	38
Pages of publication	5726
a	31.709 ± 0.009 Å
b	7.843 ± 0.002 Å
c	21.873 ± 0.006 Å
α	90°
β	131.327 ± 0.004°
γ	90°
Cell volume	4084.9 ± 1.9 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 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	0.0391
Residual factor for significantly intense reflections	0.0318
Weighted residual factors for significantly intense reflections	0.079
Weighted residual factors for all reflections included in the refinement	0.0837
Goodness-of-fit parameter for all reflections included in the refinement	1.051
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
229151 (current)	2019-11-17	cif/ Updating files of 7231489, 7231490, 7231491, 7231492, 7231493 Original log message: Adding full bibliography for 7231489--7231493.cif.	7231493.cif
210447	2018-09-05	cif/ Adding structures of 7231489, 7231490, 7231491, 7231492, 7231493 via cif-deposit CGI script.	7231493.cif