Crystallography Open Database

Information card for entry 4112471

Preview

Coordinates	4112471.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C27 H42.29 Cl N P2 Rh
Calculated formula	C27 H42.295 Cl N P2 Rh
Title of publication	Facile Oxidative Addition of N-C and N-H Bonds to Monovalent Rhodium and Iridium
Authors of publication	Oleg V. Ozerov; Chengyun Guo; Vyacheslav A. Papkov; Bruce M. Foxman
Journal of publication	Journal of the American Chemical Society
Year of publication	2004
Journal volume	126
Pages of publication	4792 - 4793
a	13.376 ± 0.004 Å
b	13.626 ± 0.006 Å
c	32.675 ± 0.011 Å
α	90°
β	90°
γ	90°
Cell volume	5955 ± 4 Å³
Cell temperature	294 K
Ambient diffraction temperature	294 K
Number of distinct elements	6
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.0955
Residual factor for significantly intense reflections	0.0584
Weighted residual factors for all reflections	0.1145
Weighted residual factors for significantly intense reflections	0.0609
Weighted residual factors for all reflections included in the refinement	0.0609
Goodness-of-fit parameter for all reflections included in the refinement	1.1445
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
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4112471.cif
120077	2014-07-12	Adding DOIs to range 4/11 structures.	4112471.cif
64861	2012-08-29	cif/ Adding structures of 4112471 via cif-deposit CGI script.	4112471.cif