Crystallography Open Database

Information card for entry 4325855

Preview

Coordinates	4325855.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C31 H42 N3 Rh2
Calculated formula	C31 H42 N3 Rh2
Title of publication	Cooperative Double Deprotonation of Bis(2-picolyl)amine Leading to Unexpected Bimetallic Mixed Valence (M-I, MI) Rhodium and Iridium Complexes
Authors of publication	Cristina Tejel; M. Pilar del Río; Laura Asensio; Fieke J. van den Bruele; Miguel A. Ciriano; Nearchos Tsichlis i Spithas; Dennis G. H. Hetterscheid; Bas de Bruin
Journal of publication	Inorganic Chemistry
Year of publication	2011
Journal volume	50
Pages of publication	7524 - 7534
a	13.1473 ± 0.0007 Å
b	12.2378 ± 0.0007 Å
c	18.2746 ± 0.001 Å
α	90°
β	110.143 ± 0.0007°
γ	90°
Cell volume	2760.4 ± 0.3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0383
Residual factor for significantly intense reflections	0.0276
Weighted residual factors for significantly intense reflections	0.0635
Weighted residual factors for all reflections included in the refinement	0.0685
Goodness-of-fit parameter for all reflections included in the refinement	1.04
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
179361 (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 4/32/58.	4325855.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4325855.cif
46891	2012-03-21	../uploads/cif-deposit/cod/cif Adding structures of 4325855 via cif-deposit CGI script.	4325855.cif