Crystallography Open Database

Information card for entry 4075566

Preview

Coordinates	4075566.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H23 Ge2 O9.5 Re2
Calculated formula	C32 H23 Ge2 O9.5 Re2
SMILES	[Re]1([H][Re]([Ge]([OH][Ge]1(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)(C#[O])(C#[O])(C#[O])C#[O])(C#[O])(C#[O])(C#[O])C#[O].O
Title of publication	Synthesis and Structures of Oxo-Bridged Distannyl- and Digermyldirhenium Complexes
Authors of publication	Adams, Richard D.; Captain, Burjor; Hollandsworth, Carl B.; Johansson, Mikael; Smith, Jack L.
Journal of publication	Organometallics
Year of publication	2006
Journal volume	25
Journal issue	16
Pages of publication	3848
a	10.9276 ± 0.0005 Å
b	17.1569 ± 0.0008 Å
c	17.9091 ± 0.0008 Å
α	91.498 ± 0.001°
β	90.181 ± 0.001°
γ	90.273 ± 0.001°
Cell volume	3356.5 ± 0.3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0253
Residual factor for significantly intense reflections	0.0212
Weighted residual factors for significantly intense reflections	0.0498
Weighted residual factors for all reflections included in the refinement	0.0519
Goodness-of-fit parameter for all reflections included in the refinement	1.046
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
178644 (current)	2016-03-21	cif/4/07/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/07/55.	4075566.cif
120075	2014-07-11	Adding DOIs to range 4/07 structures.	4075566.cif
89807	2013-11-12	smi/4 Adding SMILES of metal carbonyls.	4075566.cif
49315	2012-03-27	../uploads/cif-deposit/cod/cif Adding structures of 4075565, 4075566, 4075567 via cif-deposit CGI script.	4075566.cif