Crystallography Open Database

Information card for entry 4080909

Preview

Coordinates	4080909.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H42 O3 Si4
Calculated formula	C40 H42 O3 Si4
Title of publication	(Me3N)Mo(CO)5-Catalyzed Reduction of DMF by Disiloxane and Disilane Moieties: Fate of the Silicon-Containing Fragments
Authors of publication	Sharma, Hemant K.; Arias-Ugarte, Renzo; Tomlinson, David; Gappa, Rie; Metta-Maga Alejandro J.; Ito, Haruhiko; Pannell, Keith H.
Journal of publication	Organometallics
Year of publication	2013
Journal volume	32
Journal issue	14
Pages of publication	3788
a	8.92 ± 0.003 Å
b	9.541 ± 0.003 Å
c	13.285 ± 0.005 Å
α	86.017 ± 0.006°
β	75.923 ± 0.006°
γ	62.423 ± 0.005°
Cell volume	970.9 ± 0.6 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0962
Residual factor for significantly intense reflections	0.0562
Weighted residual factors for significantly intense reflections	0.1432
Weighted residual factors for all reflections included in the refinement	0.1711
Goodness-of-fit parameter for all reflections included in the refinement	0.871
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
178698 (current)	2016-03-21	cif/4/08/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/08/09.	4080909.cif
87946	2013-08-27	cif/ Adding structures of 4080908, 4080909, 4080910 via cif-deposit CGI script.	4080909.cif