Crystallography Open Database

Information card for entry 7216687

Preview

Coordinates	7216687.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C44 H36 Co2 N4 O12
Calculated formula	C38 H22 Co2 N2 O10
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	9.69 ± 0.003 Å
b	11.998 ± 0.004 Å
c	19.891 ± 0.007 Å
α	96.548 ± 0.004°
β	99.122 ± 0.004°
γ	113.712 ± 0.004°
Cell volume	2049.7 ± 1.2 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	0.0571
Residual factor for significantly intense reflections	0.051
Weighted residual factors for significantly intense reflections	0.1576
Weighted residual factors for all reflections included in the refinement	0.166
Goodness-of-fit parameter for all reflections included in the refinement	1.129
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
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.	7216687.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.	7216687.cif
117769	2014-06-17	cif/ Adding structures of 7216684, 7216685, 7216686, 7216687, 7216688, 7216689 via cif-deposit CGI script.	7216687.cif