Crystallography Open Database

Information card for entry 4335124

Preview

Coordinates	4335124.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H81 B16 Rh5
Calculated formula	C40 H81 B16 Rh5
Title of publication	Supraicosahedral Polyhedra in Metallaboranes: Synthesis and Structural Characterization of 12-, 15-, and 16-Vertex Rhodaboranes
Authors of publication	Dipak Kumar Roy; Bijan Mondal; Pritam Shankhari; R. S. Anju; K. Geetharani; Shaikh M. Mobin; Sundargopal Ghosh
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	6705 - 6712
a	24.5282 ± 0.0015 Å
b	12.9676 ± 0.0007 Å
c	15.733 ± 0.0009 Å
α	90°
β	90°
γ	90°
Cell volume	5004.2 ± 0.5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	58
Hermann-Mauguin space group symbol	P n n m
Hall space group symbol	-P 2 2n
Residual factor for all reflections	0.0543
Residual factor for significantly intense reflections	0.035
Weighted residual factors for significantly intense reflections	0.0744
Weighted residual factors for all reflections included in the refinement	0.0827
Goodness-of-fit parameter for all reflections included in the refinement	1.019
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
176432 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries.	4335124.cif
101029	2014-02-10	cif/ Adding structures of 4335124 via cif-deposit CGI script.	4335124.cif