Crystallography Open Database

Information card for entry 4503278

Preview

Coordinates	4503278.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C41 H36 N6 O14 Zn2
Calculated formula	C41 H26 N6 O14 Zn2
Title of publication	Structures and Luminescent Properties of Seven Coordination Polymers of Zinc(II) and Cadmium(II) with 3,3′,4,4′-Benzophenone Tetracarboxylate Anion and Bis(imidazole)
Authors of publication	Li, Shun-Li; Lan, Ya-Qian; Ma, Jian-Fang; Yang, Jin; Wei, Guo-Hua; Zhang, Lai-Ping; Su, Zhong-Min
Journal of publication	Crystal Growth & Design
Year of publication	2008
Journal volume	8
Journal issue	2
Pages of publication	675
a	10.28 ± 0.0013 Å
b	13.627 ± 0.0018 Å
c	14.614 ± 0.0019 Å
α	93.972 ± 0.002°
β	100.465 ± 0.002°
γ	95.312 ± 0.002°
Cell volume	1996.7 ± 0.4 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	0.0935
Residual factor for significantly intense reflections	0.0583
Weighted residual factors for significantly intense reflections	0.1531
Weighted residual factors for all reflections included in the refinement	0.1631
Goodness-of-fit parameter for all reflections included in the refinement	0.895
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176432 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries.	4503278.cif
120110	2014-07-12	Adding DOIs to range 4/50 structures.	4503278.cif
41458	2012-03-13	../uploads/cif-deposit/cod/cif Adding structures of 4503274, 4503275, 4503276, 4503277, 4503278, 4503279, 4503280 via cif-deposit CGI script.	4503278.cif