Crystallography Open Database

Information card for entry 4330569

Preview

Coordinates	4330569.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H44 F6 N8 O7.37 Rh S2
Calculated formula	C48 H44 F6 N8 O7.373 Rh S2
Title of publication	Syntheses and Electronic Properties of Rhodium(III) Complexes Bearing a Redox-Active Ligand
Authors of publication	Sarath Wanniarachchi; Brendan J. Liddle; Brandon Kizer; Jeewantha S. Hewage; Sergey V. Lindeman; James R. Gardinier
Journal of publication	Inorganic Chemistry
Year of publication	2012
Journal volume	51
Pages of publication	10572 - 10580
a	9.1543 ± 0.0003 Å
b	11.7994 ± 0.0005 Å
c	22.4495 ± 0.0009 Å
α	101.271 ± 0.003°
β	94.018 ± 0.003°
γ	94.028 ± 0.003°
Cell volume	2363.53 ± 0.16 Å³
Cell temperature	101.7 K
Ambient diffraction temperature	101.7 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0574
Residual factor for significantly intense reflections	0.044
Weighted residual factors for significantly intense reflections	0.1052
Weighted residual factors for all reflections included in the refinement	0.1143
Goodness-of-fit parameter for all reflections included in the refinement	1.017
Diffraction radiation wavelength	1.5418 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
179408 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/05.	4330569.cif
80022	2013-04-06	cif/ Adding structures of 4330569 via cif-deposit CGI script.	4330569.cif