Crystallography Open Database

Information card for entry 7210783

Preview

Coordinates	7210783.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H30 N8 O20 Zn3
Calculated formula	C42 H30 N8 O20 Zn3
Title of publication	Synthesis, structure and adsorption of coordination polymers constructed from 3,3′,5,5′-azobenzenetetracarboxylic acid and Zn ions
Authors of publication	Xing, Feifei; Jia, Juan; Liu, Licong; Zhong, Lina; Shao, Min; Bai, Yue-ling; Zhao, Yongmei; Zhu, Shourong; He, Xiang; Li, Mingxing
Journal of publication	CrystEngComm
Year of publication	2013
Journal volume	15
Journal issue	24
Pages of publication	4970
a	9.5593 ± 0.0013 Å
b	10.2131 ± 0.0014 Å
c	11.9424 ± 0.0016 Å
α	110.091 ± 0.002°
β	99.943 ± 0.002°
γ	95.8 ± 0.002°
Cell volume	1062.2 ± 0.3 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 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	0.1288
Residual factor for significantly intense reflections	0.0664
Weighted residual factors for significantly intense reflections	0.1432
Weighted residual factors for all reflections included in the refinement	0.1712
Goodness-of-fit parameter for all reflections included in the refinement	0.868
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
180438 (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 7/21/07.	7210783.cif
90121	2013-11-17	cif/ Adding structures of 7210781, 7210782, 7210783 via cif-deposit CGI script.	7210783.cif