Crystallography Open Database

Information card for entry 4321417

Preview

Coordinates	4321417.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C19 H33 Cl2 N3 O9 S2 Zn
Calculated formula	C19 H33 Cl2 N3 O9 S2 Zn
Title of publication	Amide Alcoholysis in Mononuclear Zinc and Cadmium Complexes Ligated by Thioether Sulfur and Nitrogen Donors
Authors of publication	Lisa M. Berreau; Magdalena M. Makowska-Grzyska; Atta M. Arif
Journal of publication	Inorganic Chemistry
Year of publication	2000
Journal volume	39
Pages of publication	4390 - 4391
a	18.9526 ± 0.0004 Å
b	18.9526 ± 0.0004 Å
c	15.8246 ± 0.0002 Å
α	90°
β	90°
γ	90°
Cell volume	5684.21 ± 0.18 Å³
Cell temperature	200 ± 1 K
Ambient diffraction temperature	200 ± 1 K
Number of distinct elements	7
Space group number	117
Hermann-Mauguin space group symbol	P -4 b 2
Hall space group symbol	P -4 -2ab
Residual factor for all reflections	0.0471
Residual factor for significantly intense reflections	0.041
Weighted residual factors for significantly intense reflections	0.1009
Weighted residual factors for all reflections included in the refinement	0.1056
Goodness-of-fit parameter for all reflections included in the refinement	1.061
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
179317 (current)	2016-03-23	cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/14.	4321417.cif
120105	2014-07-12	Adding DOIs to range 4/32 structures.	4321417.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4321417.cif
18787	2011-05-04	../uploads/cif-deposit/cod/cif Adding structures of 4321417 via cif-deposit CGI script.	4321417.cif