Crystallography Open Database

Information card for entry 4303425

Preview

Coordinates	4303425.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	{R2Cu2}n +4H2O
Formula	C4 H32 Cu2 N28 O4
Calculated formula	C4 H32 Cu2 N28 O4
Title of publication	Energetic Nitrogen-Rich Cu(II) and Cd(II) 5,5'-Azobis(tetrazolate) Complexes
Authors of publication	Guo-Hong Tao; Brendan Twamley; Jean'ne M. Shreeve
Journal of publication	Inorganic Chemistry
Year of publication	2009
Journal volume	48
Pages of publication	9918 - 9923
a	31.5983 ± 0.0009 Å
b	6.9132 ± 0.0002 Å
c	11.64 ± 0.0003 Å
α	90°
β	90°
γ	90°
Cell volume	2542.7 ± 0.12 Å³
Cell temperature	90 ± 2 K
Ambient diffraction temperature	90 ± 2 K
Number of distinct elements	5
Space group number	33
Hermann-Mauguin space group symbol	P n a 21
Hall space group symbol	P 2c -2n
Residual factor for all reflections	0.031
Residual factor for significantly intense reflections	0.0271
Weighted residual factors for significantly intense reflections	0.0643
Weighted residual factors for all reflections included in the refinement	0.0667
Goodness-of-fit parameter for all reflections included in the refinement	1.054
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
179072 (current)	2016-03-22	cif/4/30/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/30/34.	4303425.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4303425.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4303425.cif
1125	2010-04-25	cif/4/ Adding CIFs for the Inorg-Chem-2009_11-24 deposition.	4303425.cif