Crystallography Open Database

Information card for entry 4503675

Preview

Coordinates	4503675.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H20 N54 O8 Zn7
Calculated formula	C12 H6 N54 O8 Zn7
Title of publication	Temperature Tuned Synthesis of ZincN,N-bis-(1(2)H-tetrazol-5-yl)-amine Complexes: From Zn3O Cluster-Based 3-Connected 63-hcband (3,6)-Connected (43)2(46)-kgdLayers to Zn5(OH)4Chain-Based 3D Open Framework
Authors of publication	Jiang, Tao; Zhang, Xian-Ming
Journal of publication	Crystal Growth & Design
Year of publication	2008
Journal volume	8
Journal issue	8
Pages of publication	3077
a	13.6663 ± 0.0009 Å
b	13.6663 ± 0.0009 Å
c	13.009 ± 0.0016 Å
α	90°
β	90°
γ	120°
Cell volume	2104.1 ± 0.3 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	5
Space group number	165
Hermann-Mauguin space group symbol	P -3 c 1
Hall space group symbol	-P 3 2"c
Residual factor for all reflections	0.0686
Residual factor for significantly intense reflections	0.0591
Weighted residual factors for significantly intense reflections	0.1376
Weighted residual factors for all reflections included in the refinement	0.1435
Goodness-of-fit parameter for all reflections included in the refinement	1.17
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
179571 (current)	2016-03-24	cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/36.	4503675.cif
120110	2014-07-12	Adding DOIs to range 4/50 structures.	4503675.cif
41703	2012-03-13	../uploads/cif-deposit/cod/cif Adding structures of 4503674, 4503675, 4503676 via cif-deposit CGI script.	4503675.cif