Crystallography Open Database

Information card for entry 7038692

Preview

Coordinates	7038692.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H92 P8 Re2 Si2
Calculated formula	C38 H92 P8 Re2 Si2
SMILES	C(=[Re](C#C[Si](C)(C)C)([P](C)(C)C)([P](C)(C)C)([P](C)(C)C)[P](C)(C)C)=CC=C=[Re](C#C[Si](C)(C)C)([P](C)(C)C)([P](C)(C)C)([P](C)(C)C)[P](C)(C)C
Title of publication	Electronic communication in phosphine substituted bridged dirhenium complexes - clarifying ambiguities raised by the redox non-innocence of the C4H2- and C4-bridges.
Authors of publication	Li, Yan; Blacque, Olivier; Fox, Thomas; Luber, Sandra; Polit, Walther; Winter, Rainer F.; Venkatesan, Koushik; Berke, Heinz
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2016
Journal volume	45
Journal issue	13
Pages of publication	5783 - 5799
a	15.5085 ± 0.0011 Å
b	9.9898 ± 0.0004 Å
c	18.9014 ± 0.0008 Å
α	90°
β	93.969 ± 0.005°
γ	90°
Cell volume	2921.3 ± 0.3 Å³
Cell temperature	183 ± 2 K
Ambient diffraction temperature	183 ± 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	0.0375
Residual factor for significantly intense reflections	0.028
Weighted residual factors for significantly intense reflections	0.06
Weighted residual factors for all reflections included in the refinement	0.0623
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
181636 (current)	2016-04-05	cif/ Updating files of 7038690, 7038691, 7038692, 7038693, 7038694, 7038695 Original log message: Adding full bibliography for 7038690--7038695.cif.	7038692.cif
177272	2016-03-04	cif/ Adding structures of 7038690, 7038691, 7038692, 7038693, 7038694, 7038695 via cif-deposit CGI script.	7038692.cif