Crystallography Open Database

Information card for entry 4504406

Preview

Coordinates	4504406.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H8 Cd2 Cl3 Cu N10
Calculated formula	C12 H8 Cd2 Cl3 Cu N10
Title of publication	Heterometallic Tetrazole Coordination Polymer Formed through 2 + 3 Cycloaddition Reaction between Inorganic Complexes in the Presence of Lewis Acid
Authors of publication	Tang, Yun-Zhi; Wang, Guo-Xi; Ye, Qiong; Xiong, Ren-Gen; Yuan, Rong-Xin
Journal of publication	Crystal Growth & Design
Year of publication	2007
Journal volume	7
Journal issue	12
Pages of publication	2382 - 2386
a	6.6799 ± 0.0005 Å
b	17.8844 ± 0.0014 Å
c	14.9376 ± 0.0012 Å
α	90°
β	90°
γ	90°
Cell volume	1784.5 ± 0.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	57
Hermann-Mauguin space group symbol	P b c m
Hall space group symbol	-P 2c 2b
Residual factor for all reflections	0.0226
Residual factor for significantly intense reflections	0.0214
Weighted residual factors for significantly intense reflections	0.055
Weighted residual factors for all reflections included in the refinement	0.0556
Goodness-of-fit parameter for all reflections included in the refinement	1.063
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
179579 (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 4/50/44.	4504406.cif
132556	2015-02-28	cif/ (antanas@koala.ibt.lt) Removing '===END.*" strings that were accidentally "glued" to the '_refine_diff_density_rms' tags value from 18 CIFs in range 4.	4504406.cif
120110	2014-07-12	Adding DOIs to range 4/50 structures.	4504406.cif
45109	2012-03-20	../uploads/cif-deposit/cod/cif Adding structures of 4504405, 4504406 via cif-deposit CGI script.	4504406.cif