Crystallography Open Database

Information card for entry 8102260

Preview

Coordinates	8102260.cif

Structure parameters

Chemical name	catena-poly{[chloromercury(II)]-μ-[2-(2-pyridylmethyl amino) ethanesulfonato-κ^4^N, N^'^,O: O^'^]}
Formula	C8 H11 Cl Hg N2 O3 S
Calculated formula	C8 H11 Cl Hg N2 O3 S
Title of publication	Crystal structure of catena-poly{[chloromercury(II)]-µ-[2-(2-pyridyl-methylamino)ethanesulfonato-κ4N,N',O:O']}, [Hg(C8H11N2O3S)(Cl)]n
Authors of publication	Zhong-Xiang Du; Jun-Xia Li
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2008
Journal volume	223
Journal issue	3
Pages of publication	211
a	6.9232 ± 0.0007 Å
b	24.089 ± 0.002 Å
c	7.5097 ± 0.0007 Å
α	90°
β	110.609 ± 0.001°
γ	90°
Cell volume	1172.27 ± 0.19 Å³
Cell temperature	291 ± 2 K
Ambient diffraction temperature	291 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0285
Residual factor for significantly intense reflections	0.0259
Weighted residual factors for significantly intense reflections	0.0638
Weighted residual factors for all reflections included in the refinement	0.0648
Goodness-of-fit parameter for all reflections included in the refinement	1.099
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
176728 (current)	2016-02-18	cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 8.	8102260.cif
35911	2012-02-28	cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree.	8102260.cif
12999	2011-03-06	../uploads/cif-deposit/cod/cif Adding structures of 8102260 via cif-deposit CGI script.	8102260.cif