Crystallography Open Database

Information card for entry 4502013

4502012 << 4502013 >> 4502014

Preview

Coordinates	4502013.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Cadmium-Sulfate
Formula	C4 H10 Cd5 N20 O10 S2
Calculated formula	C4 H8 Cd5 N20 O10 S2
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	8.8562 ± 0.0006 Å
b	9.5734 ± 0.0007 Å
c	13.3383 ± 0.0009 Å
α	90°
β	102.914 ± 0.001°
γ	90°
Cell volume	1102.27 ± 0.13 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	0.0268
Weighted residual factors for significantly intense reflections	0.0661
Weighted residual factors for all reflections included in the refinement	0.0671
Goodness-of-fit parameter for all reflections included in the refinement	1.115
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.	4502013.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4502013.cif
36203	2012-03-01	../uploads/cif-deposit/cod/cif Adding structures of 4502009, 4502010, 4502011, 4502012, 4502013, 4502014 via cif-deposit CGI script.	4502013.cif