Crystallography Open Database

Information card for entry 4502010

4502009 << 4502010 >> 4502011

Preview

Coordinates	4502010.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Cadmium-Sulfate
Formula	C5 H5 Cd N5 O4 S
Calculated formula	C5 H5 Cd N5 O4 S
Title of publication	Use of Polyazaheterocycles in the Assembly of New Cadmium Sulfate Frameworks: Synthesis, Structure, and Properties
Authors of publication	Paul, Avijit Kumar; Sanyal, Udishnu; Natarajan, Srinivasan
Journal of publication	Crystal Growth & Design
Year of publication	2010
Journal volume	10
Journal issue	9
Pages of publication	4161
a	6.701 ± 0.0013 Å
b	11.86 ± 0.002 Å
c	11.19 ± 0.002 Å
α	90°
β	103.73 ± 0.03°
γ	90°
Cell volume	863.9 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0297
Residual factor for significantly intense reflections	0.0244
Weighted residual factors for significantly intense reflections	0.0557
Weighted residual factors for all reflections included in the refinement	0.0575
Goodness-of-fit parameter for all reflections included in the refinement	1.085
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
179551 (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 4/50/20.	4502010.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4502010.cif
36203	2012-03-01	../uploads/cif-deposit/cod/cif Adding structures of 4502009, 4502010, 4502011, 4502012, 4502013, 4502014 via cif-deposit CGI script.	4502010.cif