Crystallography Open Database

Information card for entry 4109965

Preview

Coordinates	4109965.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C26 H46 Cl2 N4 Si5
Calculated formula	C26 H46 Cl2 N4 Si5
SMILES	C1(c2ccccc2)=[N]([Si]2(N1[Si](C)(C)C)(Cl)(Cl)[N](=C(c1ccccc1)N2[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C
Title of publication	Synthesis and Structures of Heteroleptic Silylenes
Authors of publication	Cheuk-Wai So; Herbert W. Roesky; Prabhuodeyara M. Gurubasavaraj; Rainer B. Oswald; Michael T. Gamer; Peter G. Jones; Steffen Blaurock
Journal of publication	Journal of the American Chemical Society
Year of publication	2007
Journal volume	129
Pages of publication	12049 - 12054
a	21.2473 ± 0.0015 Å
b	8.9149 ± 0.0005 Å
c	18.8561 ± 0.0014 Å
α	90°
β	90.016 ± 0.006°
γ	90°
Cell volume	3571.7 ± 0.4 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 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	0.0433
Residual factor for significantly intense reflections	0.0321
Weighted residual factors for significantly intense reflections	0.0812
Weighted residual factors for all reflections included in the refinement	0.0857
Goodness-of-fit parameter for all reflections included in the refinement	1.027
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
178845 (current)	2016-03-21	cif/4/10/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/10/99.	4109965.cif
120076	2014-07-11	Adding DOIs to range 4/10 structures.	4109965.cif
58744	2012-05-30	cif/ Adding structures of 4109965 via cif-deposit CGI script.	4109965.cif