Crystallography Open Database

Information card for entry 7207131

7207130 << 7207131 >> 7207132

Preview

Coordinates	7207131.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C164 H170 Co4 N32 O5 S8
Calculated formula	C164 H168 Co4 N32 O5 S8
Title of publication	Coordination polymers with divergent 4′-tert-butyl-4,2′:6′,4′′-terpyridine linkers: from aryl-aryl to ball-and-socket packing
Authors of publication	Constable, Edwin C.; Housecroft, Catherine E.; Kopecky, Peter; Neuburger, Markus; Zampese, Jennifer A.; Zhang, Guoqi
Journal of publication	CrystEngComm
Year of publication	2012
Journal volume	14
Journal issue	2
Pages of publication	446
a	27.298 ± 0.004 Å
b	10.7049 ± 0.0012 Å
c	15.889 ± 0.003 Å
α	90°
β	122.48 ± 0.01°
γ	90°
Cell volume	3916.8 ± 1.1 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	5
Hermann-Mauguin space group symbol	C 1 2 1
Hall space group symbol	C 2y
Residual factor for all reflections	0.046
Residual factor for significantly intense reflections	0.0455
Weighted residual factors for significantly intense reflections	0.1181
Weighted residual factors for all reflections included in the refinement	0.1185
Goodness-of-fit parameter for all reflections included in the refinement	1.088
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
176432 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries.	7207131.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7207131.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7207131.cif
32486	2012-02-09	../uploads/cif-deposit/cod/cif Adding structures of 7207131, 7207132, 7207133, 7207134 via cif-deposit CGI script.	7207131.cif