Crystallography Open Database

Information card for entry 4331512

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Structure parameters

Formula	C68 H57 Ge5 O5 Rh3
Calculated formula	C68 H57 Ge5 O5 Rh3
Title of publication	Rhodium Cluster Complexes Containing Bridging Phenylgermanium Ligands
Authors of publication	Adams, Richard D.; Smith, Jack L.
Journal of publication	Inorganic Chemistry
Year of publication	2005
Journal volume	44
Journal issue	12
Pages of publication	4276 - 4281
a	13.1447 ± 0.0006 Å
b	21.6775 ± 0.001 Å
c	23.6975 ± 0.0011 Å
α	90°
β	91.596 ± 0.001°
γ	90°
Cell volume	6749.8 ± 0.5 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
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	0.1787
Residual factor for significantly intense reflections	0.1162
Weighted residual factors for significantly intense reflections	0.233
Weighted residual factors for all reflections included in the refinement	0.2632
Goodness-of-fit parameter for all reflections included in the refinement	1.125
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
301839 (current)	2025-08-21	Add cross-references to PubChem compounds in COD range 4/33/ Each referenced PubChem compound corresponds to the full crystal structure.	4331512.cif
179418	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 4/33/15.	4331512.cif
97671	2014-01-29	cif/ Adding structures of 4331512 via cif-deposit CGI script.	4331512.cif