Crystallography Open Database

Information card for entry 4324428

Preview

Coordinates	4324428.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C50 H44 Cl2 I3 N4 P2 Rh
Calculated formula	C50 H44 Cl2 I3 N4 P2 Rh
SMILES	C1C=[N]([Rh]([N]=1Nc1ccccc1)([P](c1ccccc1)(c1ccccc1)c1ccccc1)(Cl)([P](c1ccccc1)(c1ccccc1)c1ccccc1)Cl)Nc1ccccc1.I[I-]I
Title of publication	Osazone Anion Radical Complex of Rhodium(III)
Authors of publication	Sarat Chandra Patra; Manas Kumar Biswas; Amarendra Nath Maity; Prasanta Ghosh
Journal of publication	Inorganic Chemistry
Year of publication	2011
Journal volume	50
Pages of publication	1331 - 1338
a	12.0948 ± 0.0008 Å
b	13.6017 ± 0.0007 Å
c	15.2096 ± 0.0008 Å
α	90°
β	100.467 ± 0.002°
γ	90°
Cell volume	2460.5 ± 0.2 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	7
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/c 1
Hall space group symbol	-P 2yc
Residual factor for all reflections	0.0935
Residual factor for significantly intense reflections	0.0663
Weighted residual factors for significantly intense reflections	0.1743
Weighted residual factors for all reflections included in the refinement	0.2048
Goodness-of-fit parameter for all reflections included in the refinement	1.137
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
179347 (current)	2016-03-23	cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/44.	4324428.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4324428.cif
41136	2012-03-12	../uploads/cif-deposit/cod/cif Adding structures of 4324428 via cif-deposit CGI script.	4324428.cif