Crystallography Open Database

Information card for entry 7223567

Preview

Coordinates	7223567.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C33 H24 Cd2 N8 O14
Calculated formula	C33 H22 Cd2 N8 O14
Title of publication	Syntheses, structures and luminescence of a series of coordination polymers constructed with 4-substituted 1,2,4-triazole and biscarboxylate co-ligands
Authors of publication	Han, Shan-Shan; Shi, Lu-Lu; Li, Ke; Zhao, Shan; Li, Bao-Long; Wu, Bing
Journal of publication	RSC Adv.
Year of publication	2015
Journal volume	5
Journal issue	129
Pages of publication	107166
a	15.964 ± 0.004 Å
b	16.319 ± 0.003 Å
c	16.578 ± 0.004 Å
α	90°
β	118.02 ± 0.004°
γ	90°
Cell volume	3812.6 ± 1.5 Å³
Cell temperature	223 ± 2 K
Ambient diffraction temperature	223 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/a 1
Hall space group symbol	-P 2yab
Residual factor for all reflections	0.0789
Residual factor for significantly intense reflections	0.0626
Weighted residual factors for significantly intense reflections	0.1492
Weighted residual factors for all reflections included in the refinement	0.1595
Goodness-of-fit parameter for all reflections included in the refinement	1.093
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
171628 (current)	2015-12-19	cif/ Adding structures of 7223565, 7223566, 7223567, 7223568, 7223569, 7223570, 7223571, 7223572 via cif-deposit CGI script.	7223567.cif