Crystallography Open Database

Information card for entry 4305886

Preview

Coordinates	4305886.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C0.5 H28 K10 O13.5 Se10 Sn4 Te7 Zn4
Calculated formula	C0.5 K9.98 O13.5 Se10 Sn4 Te7 Zn4
Title of publication	One-Size Adjustable-Gap Cluster Anions: Systematic Approach to Multinary, Water-Soluble Chalcogenidometalate Compounds
Authors of publication	Felicitas Lips; Stefanie Dehnen
Journal of publication	Inorganic Chemistry
Year of publication	2008
Journal volume	47
Pages of publication	5561 - 5563
a	27.121 ± 0.005 Å
b	18.988 ± 0.004 Å
c	26.821 ± 0.005 Å
α	90°
β	98.19 ± 0.03°
γ	90°
Cell volume	13671 ± 5 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	8
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.091
Residual factor for significantly intense reflections	0.068
Weighted residual factors for significantly intense reflections	0.1793
Weighted residual factors for all reflections included in the refinement	0.1927
Goodness-of-fit parameter for all reflections included in the refinement	1.042
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
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4305886.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4305886.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4305886.cif
1167	2010-05-13	cif/ Adding data from the rest of 2009 RSC journals, Inorg-Chem-2008 and Chem-Comm-2010_18-19.	4305886.cif