Crystallography Open Database

Information card for entry 7218783

Preview

Coordinates	7218783.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C52 H40 Cu5 N4 O23
Calculated formula	C52 H34 Cu5 N4 O23
Title of publication	Syntheses, crystal structures, photoluminescent/magnetic properties of four new coordination polymers based on 2,3′,4,5′-biphenyltetracarboxylic acid
Authors of publication	Qiao, Jin-Zhong; Zhan, Mao-Sheng; Hu, Tuo-Ping
Journal of publication	RSC Adv.
Year of publication	2014
Journal volume	4
Journal issue	107
Pages of publication	62285
a	10.8509 ± 0.0005 Å
b	11.166 ± 0.0007 Å
c	12.6776 ± 0.0007 Å
α	107.269 ± 0.005°
β	95.042 ± 0.004°
γ	115.812 ± 0.005°
Cell volume	1277.63 ± 0.15 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0527
Residual factor for significantly intense reflections	0.0416
Weighted residual factors for significantly intense reflections	0.1127
Weighted residual factors for all reflections included in the refinement	0.1219
Goodness-of-fit parameter for all reflections included in the refinement	1.054
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
180518 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/87.	7218783.cif
127512	2014-11-19	cif/ Adding structures of 7218783, 7218784, 7218785, 7218786 via cif-deposit CGI script.	7218783.cif