Crystallography Open Database

Information card for entry 1514340

Preview

Coordinates	1514340.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C8 H18 O4 Si2
Calculated formula	C8 H18 O4 Si2
SMILES	[Si](OC(=O)C(=O)O[Si](C)(C)C)(C)(C)C
Title of publication	Catalytic hydrosilylation of oxalic acid: chemoselective formation of functionalized C2-products
Authors of publication	Feghali, Elias; Jacquet, Olivier; Thuéry, Pierre; Cantat, Thibault
Journal of publication	Catalysis Science & Technology
Year of publication	2014
Journal volume	4
Journal issue	8
Pages of publication	2230
a	10.5425 ± 0.0007 Å
b	11.9183 ± 0.0008 Å
c	11.4221 ± 0.0008 Å
α	90°
β	108.364 ± 0.004°
γ	90°
Cell volume	1362.08 ± 0.16 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0552
Residual factor for significantly intense reflections	0.04
Weighted residual factors for significantly intense reflections	0.0999
Weighted residual factors for all reflections included in the refinement	0.106
Goodness-of-fit parameter for all reflections included in the refinement	1.03
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
176729 (current)	2016-02-18	cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1.	1514340.cif
121559	2014-08-08	cif/ Updating files of 1514340 Original log message: Adding full bibliography for 1514340.cif.	1514340.cif
109488	2014-04-15	cif/ Adding structures of 1514340 via cif-deposit CGI script.	1514340.cif