Crystallography Open Database

Information card for entry 1519254

1519253 << 1519254 >> 1519255

Preview

Coordinates	1519254.cif

Structure parameters

Formula	C8 H22 O5 Si2
Calculated formula	C8 H22 O5 Si2
SMILES	[Si](O)(O[Si](O)(O)C(C)(C)C)(O)C(C)(C)C
Title of publication	C8H22O5Si2
Authors of publication	Taylor, Peter. G.; Coles, Simon J.; Hursthouse, Michael B.
Journal of publication	Crystal Structure Report Archive
Year of publication	2000
Pages of publication	774
a	6.2157 ± 0.0012 Å
b	9.6972 ± 0.0019 Å
c	11.921 ± 0.002 Å
α	89.14 ± 0.03°
β	79.65 ± 0.03°
γ	81.51 ± 0.03°
Cell volume	699.1 ± 0.2 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 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	0.0602
Residual factor for significantly intense reflections	0.0443
Weighted residual factors for significantly intense reflections	0.1168
Weighted residual factors for all reflections included in the refinement	0.1264
Goodness-of-fit parameter for all reflections included in the refinement	1.065
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.	1519254.cif
135595	2015-05-06	cif/ Adding structures of 1519254 via cif-deposit CGI script.	1519254.cif