Crystallography Open Database

Information card for entry 7005895

Preview

Coordinates	7005895.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C11 H21 Cl O3 P Rh
Calculated formula	C11 H21 Cl O3 P Rh
SMILES	C(O)[P](CO)(CO)[Rh]123([CH]4=[CH]1CC[CH]2=[CH]3CC4)Cl
Title of publication	Synthesis and X-ray structures of water-soluble tris(hydroxymethyl)phosphine complexes of rhodium(I).
Authors of publication	Lorenzini, Fabio; Patrick, Brian O.; James, Brian R.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2007
Journal issue	30
Pages of publication	3224 - 3226
a	12.5827 ± 0.0005 Å
b	18.3977 ± 0.0007 Å
c	11.7294 ± 0.0004 Å
α	90°
β	90°
γ	90°
Cell volume	2715.27 ± 0.18 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	29
Hermann-Mauguin space group symbol	P c a 21
Hall space group symbol	P 2c -2ac
Residual factor for all reflections	0.0416
Residual factor for significantly intense reflections	0.0318
Weighted residual factors for significantly intense reflections	0.068
Weighted residual factors for all reflections included in the refinement	0.0719
Goodness-of-fit parameter for all reflections included in the refinement	1.018
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
179762 (current)	2016-03-25	cif/7/00/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/00/58.	7005895.cif
120443	2014-07-15	Adding 17924 DOIs guessed from source file names.	7005895.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7005895.cif
1186	2010-06-03	Adding CIFs from Chem-Comm-2010_20-22/ and Dalton-Trans-2007/ processing.	7005895.cif