Crystallography Open Database

Information card for entry 4086837

Preview

Coordinates	4086837.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H72 N2 O6 Si10
Calculated formula	C32 H72 N2 O6 Si10
SMILES	C1[N]23CCO[Si]2(OC1)(OCC3)[Si]1([Si](C)(C)[Si](C)(C)[Si]([Si]234[N](CCO2)(CCO3)CCO4)([Si](C)(C)C)[Si](C)(C)[Si]1(C)C)[Si](C)(C)C.c1ccccc1
Title of publication	Electron Transfer and Modification of Oligosilanylsilatranes and Related Derivatives
Authors of publication	Aghazadeh Meshgi, Mohammad; Baumgartner, Judith; Jouikov, Viatcheslav V.; Marschner, Christoph
Journal of publication	Organometallics
Year of publication	2016
a	21.512 ± 0.005 Å
b	10.6939 ± 0.0019 Å
c	22.77 ± 0.004 Å
α	90°
β	115.423 ± 0.006°
γ	90°
Cell volume	4730.9 ± 1.6 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0585
Residual factor for significantly intense reflections	0.0526
Weighted residual factors for significantly intense reflections	0.1171
Weighted residual factors for all reflections included in the refinement	0.1204
Goodness-of-fit parameter for all reflections included in the refinement	1.184
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
189668 (current)	2017-01-01	cif/ Adding structures of 4086834, 4086835, 4086836, 4086837 via cif-deposit CGI script.	4086837.cif