Crystallography Open Database

Information card for entry 1556545

Preview

Coordinates	1556545.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	1,3-di-cyclopentyl-1,1,3,3-tetrahydroxysiloxane
Chemical name	1,3-di-cyclopentyl-1,1,3,3-tetrahydroxysiloxane
Formula	C10 H22 O5 Si2
Calculated formula	C10 H22 O5 Si2
Title of publication	Preparation and Molecular Structure of a Cyclopentyl-Substituted Cage Hexasilsesquioxane T6 (T = cyclopentyl-SiO1.5) Starting from the Corresponding Silanetriol
Authors of publication	Kahr, J.; Belaj, F.; Pietschnig, R.
Journal of publication	Inorganics
Year of publication	2017
Journal volume	5
Pages of publication	66
a	11.5359 ± 0.0016 Å
b	6.7079 ± 0.0009 Å
c	10.1493 ± 0.0013 Å
α	90°
β	115.83 ± 0.004°
γ	90°
Cell volume	706.9 ± 0.17 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	4
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	0.0413
Residual factor for significantly intense reflections	0.0326
Weighted residual factors for significantly intense reflections	0.0829
Weighted residual factors for all reflections included in the refinement	0.0873
Goodness-of-fit parameter for all reflections included in the refinement	1.095
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
245046 (current)	2019-12-13	cif/ Adding structures of 1556545, 1556546, 1556547 via cif-deposit CGI script.	1556545.cif