Crystallography Open Database

Information card for entry 7214586

Preview

Coordinates	7214586.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C27 H15 N2 O10 Zn2
Calculated formula	C27 H15 N2 O10 Zn2
Title of publication	Coordination polymers based on 3,3′,4,4′-benzophenone-tetracarboxylate and N-containing pillars: syntheses, structure, characterization and properties
Authors of publication	Yang, Li-Rong; Zhang, Huai-Min; You, Qian-qian; Wu, Lan-Zhi; Liu, Liu; Song, Shuang
Journal of publication	CrystEngComm
Year of publication	2013
Journal volume	15
Journal issue	37
Pages of publication	7505
a	11.0612 ± 0.0016 Å
b	15.0262 ± 0.0017 Å
c	16.7833 ± 0.0016 Å
α	90°
β	95.491 ± 0.001°
γ	90°
Cell volume	2776.7 ± 0.6 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0397
Residual factor for significantly intense reflections	0.0317
Weighted residual factors for significantly intense reflections	0.0816
Weighted residual factors for all reflections included in the refinement	0.0846
Goodness-of-fit parameter for all reflections included in the refinement	1.039
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
180476 (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 7/21/45.	7214586.cif
110313	2014-04-18	cif/ Adding structures of 7214585, 7214586, 7214587 via cif-deposit CGI script.	7214586.cif