Crystallography Open Database

Information card for entry 4503045

Preview

Coordinates	4503045.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C8 H14 Cu2 N8 O9
Calculated formula	C8 H14 Cu2 N8 O9
Title of publication	pH-Dependent Cu(II) Coordination Polymers with Tetrazole-1-acetic Acid: Synthesis, Crystal Structures, EPR and Magnetic Properties
Authors of publication	Yu, Qing; Zhang, Xiuqing; Bian, Hedong; Liang, Hong; Zhao, Bin; Yan, Shiping; Liao, Daizheng
Journal of publication	Crystal Growth & Design
Year of publication	2008
Journal volume	8
Journal issue	4
Pages of publication	1140
a	8.5325 ± 0.0012 Å
b	9.4912 ± 0.0014 Å
c	11.047 ± 0.0016 Å
α	106.534 ± 0.002°
β	93.207 ± 0.002°
γ	107.294 ± 0.002°
Cell volume	809.2 ± 0.2 Å³
Cell temperature	294 ± 2 K
Ambient diffraction temperature	294 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0376
Residual factor for significantly intense reflections	0.0284
Weighted residual factors for significantly intense reflections	0.0705
Weighted residual factors for all reflections included in the refinement	0.0756
Goodness-of-fit parameter for all reflections included in the refinement	1.029
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
179561 (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 4/50/30.	4503045.cif
120110	2014-07-12	Adding DOIs to range 4/50 structures.	4503045.cif
41309	2012-03-13	../uploads/cif-deposit/cod/cif Adding structures of 4503045 via cif-deposit CGI script.	4503045.cif