Crystallography Open Database

Information card for entry 7216686

Preview

Coordinates	7216686.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H18 N2 O5 Zn
Calculated formula	C19 H11 N O4 Zn
Title of publication	Six new coordination polymers based on a tritopic pyridyldicarboxylate ligand: structural, magnetic and sorption properties
Authors of publication	Ding, Tao; Ren, Li-Di; Du, Xiao-Di; Quan, Li; Gao, Zi-Wei; Zhang, Wei-Qiang; Zheng, Chang-Zheng
Journal of publication	CrystEngComm
Year of publication	2014
Journal volume	16
Journal issue	33
Pages of publication	7790
a	17.343 ± 0.017 Å
b	15.231 ± 0.015 Å
c	8.426 ± 0.012 Å
α	90°
β	117.09 ± 0.02°
γ	90°
Cell volume	1982 ± 4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0404
Residual factor for significantly intense reflections	0.0366
Weighted residual factors for significantly intense reflections	0.107
Weighted residual factors for all reflections included in the refinement	0.1088
Goodness-of-fit parameter for all reflections included in the refinement	1.152
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
180497 (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 7/21/66.	7216686.cif
121618	2014-08-08	cif/ Updating files of 7216684, 7216685, 7216686, 7216687, 7216688, 7216689 Original log message: Adding full bibliography for 7216684--7216689.cif.	7216686.cif
117769	2014-06-17	cif/ Adding structures of 7216684, 7216685, 7216686, 7216687, 7216688, 7216689 via cif-deposit CGI script.	7216686.cif