Crystallography Open Database

Information card for entry 4074456

Preview

Coordinates	4074456.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H75 O11.5 Si6
Calculated formula	C38 H75 O11.5 Si6
Title of publication	The First Niobasilsesquioxanes§
Authors of publication	Lorenz, Volker; Blaurock, Steffen; Görls, Helmar; Edelmann, Frank T.
Journal of publication	Organometallics
Year of publication	2006
Journal volume	25
Journal issue	25
Pages of publication	5922
a	12.6692 ± 0.0002 Å
b	19.5522 ± 0.0003 Å
c	20.8522 ± 0.0005 Å
α	90°
β	103.511 ± 0.001°
γ	90°
Cell volume	5022.36 ± 0.16 Å³
Cell temperature	183 ± 2 K
Ambient diffraction temperature	183 ± 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	0.114
Residual factor for significantly intense reflections	0.0797
Weighted residual factors for significantly intense reflections	0.2141
Weighted residual factors for all reflections included in the refinement	0.2388
Goodness-of-fit parameter for all reflections included in the refinement	1.047
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4074456.html