Crystallography Open Database

Information card for entry 7112867

Preview

Coordinates	7112867.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	rhodium selenium chloride
Chemical name	dirhodium nonaselenium hexachloride
Formula	Cl6 Rh2 Se9
Calculated formula	Cl6 Rh2 Se9
SMILES	[Rh]12([Se]3[Se][Se]4[Rh]5([Se]([Se][Se]14)[Se]2[Se][Se]35)(Cl)(Cl)Cl)(Cl)(Cl)Cl
Title of publication	The first nonaselenium ring.
Authors of publication	Demchenko, Pavlo Yu; Gladyshevskii, Roman E.; Volkov, Sergei V.; Yanko, Oleg G.; Kharkova, Lyudmila B.; Fokina, Zoya A.; Fokin, Andrey A.
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2010
Journal volume	46
Journal issue	25
Pages of publication	4520 - 4522
a	12.20346 ± 0.00009 Å
b	12.20346 ± 0.00009 Å
c	23.7125 ± 0.0003 Å
α	90°
β	90°
γ	90°
Cell volume	3531.37 ± 0.06 Å³
Cell temperature	297 ± 1 K
Ambient diffraction temperature	297 ± 1 K
Number of distinct elements	3
Space group number	88
Hermann-Mauguin space group symbol	I 41/a :2
Hall space group symbol	-I 4ad
Residual factor R(I) for significantly intense reflections	0.028175
Goodness-of-fit parameter for all reflections	1.1651
Method of determination	powder diffraction
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.5406 Å
Diffraction radiation type	CuKα~1~
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
180242 (current)	2016-03-26	cif/7/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/11/28.	7112867.cif
171772	2015-12-31	cif/ (antanas@kurmis) Removing surrounding qoutes ("'") from the _chemical_name_common tag values in multiple entries.	7112867.cif
112132	2014-04-29	cif/ Adding structures of 7112867 via cif-deposit CGI script.	7112867.cif