Crystallography Open Database

Information card for entry 7206663

7206662 << 7206663 >> 7206664

Preview

Coordinates	7206663.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18.5 H19.5 N2.5 O7.5 S Zn
Calculated formula	C17 H12 N2 O5 S Zn
Title of publication	Topological variability of Zn(ii) and Co(ii) 3D coordination polymers obtained through solvothermal in situ disulfide cleavage
Authors of publication	Bu, Yang; Jiang, Feilong; Zhang, Shuquan; Ma, Jie; Li, Xingjun; Hong, Maochun
Journal of publication	CrystEngComm
Year of publication	2011
Journal volume	13
Journal issue	21
Pages of publication	6323
a	19.2774 ± 0.0008 Å
b	20.9886 ± 0.0007 Å
c	43.284 ± 0.0016 Å
α	90°
β	90°
γ	90°
Cell volume	17513 ± 1.1 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	70
Hermann-Mauguin space group symbol	F d d d :2
Hall space group symbol	-F 2uv 2vw
Residual factor for all reflections	0.0513
Residual factor for significantly intense reflections	0.046
Weighted residual factors for significantly intense reflections	0.1401
Weighted residual factors for all reflections included in the refinement	0.1466
Goodness-of-fit parameter for all reflections included in the refinement	1.025
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
176453 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7206663.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7206663.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7206663.cif
29975	2011-11-09	../uploads/cif-deposit/cod/cif Adding structures of 7206663, 7206664 via cif-deposit CGI script.	7206663.cif