Crystallography Open Database

Information card for entry 7232931

Preview

Coordinates	7232931.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H17 Cd N2 O10
Calculated formula	C28 H17 Cd N2 O10
Title of publication	Three coordination polymers based on 3-(3′,5′-dicarboxylphenoxy)phthalic acid and auxiliary N-donor ligands: syntheses, structures, and highly selective sensing for nitro explosives and Fe3+ ions
Authors of publication	Wang, Li-Na; Zhang, Yan-Hong; Jiang, Shuang; Liu, Zi-Zhong
Journal of publication	CrystEngComm
Year of publication	2019
Journal volume	21
Journal issue	31
Pages of publication	4557
a	26.409 ± 0.004 Å
b	9.7523 ± 0.0012 Å
c	20.678 ± 0.003 Å
α	90°
β	105.007 ± 0.005°
γ	90°
Cell volume	5144 ± 1.3 Å³
Cell temperature	273 ± 2 K
Ambient diffraction temperature	273 ± 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	0.0418
Residual factor for significantly intense reflections	0.0287
Weighted residual factors for significantly intense reflections	0.0586
Weighted residual factors for all reflections included in the refinement	0.0629
Goodness-of-fit parameter for all reflections included in the refinement	1.062
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
223673 (current)	2019-11-07	cif/ Updating files of 7232930, 7232931, 7232932 Original log message: Adding full bibliography for 7232930--7232932.cif.	7232931.cif
216504	2019-06-25	cif/ Adding structures of 7232930, 7232931, 7232932 via cif-deposit CGI script.	7232931.cif