Crystallography Open Database

Information card for entry 4502283

Preview

Coordinates	4502283.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C10 H10.5 N10 O0.25 Zn
Calculated formula	C10 H8 N10 O0.25 Zn
Title of publication	ZnIIand HgIIComplexes with 2,3-Substituted-5,6-di(1H-tetrazol-5-yl)pyrazine Ligands: Roles of Substituting Groups and Synthetic Conditions on the Formation of Complexes
Authors of publication	Tao, Ying; Li, Jian-Rong; Chang, Ze; Bu, Xian-He
Journal of publication	Crystal Growth & Design
Year of publication	2010
Journal volume	10
Journal issue	2
Pages of publication	564
a	23.783 ± 0.003 Å
b	23.783 ± 0.003 Å
c	13.842 ± 0.003 Å
α	90°
β	90°
γ	120°
Cell volume	6780.5 ± 1.9 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	148
Hermann-Mauguin space group symbol	R -3 :H
Hall space group symbol	-R 3
Residual factor for all reflections	0.1121
Residual factor for significantly intense reflections	0.0744
Weighted residual factors for significantly intense reflections	0.1789
Weighted residual factors for all reflections included in the refinement	0.1969
Goodness-of-fit parameter for all reflections included in the refinement	1.123
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
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4502283.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4502283.cif
36334	2012-03-01	../uploads/cif-deposit/cod/cif Adding structures of 4502282, 4502283, 4502284, 4502285, 4502286, 4502287, 4502288 via cif-deposit CGI script.	4502283.cif