Crystallography Open Database

Information card for entry 4106537

Preview

Coordinates	4106537.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H56 N3 P Si3
Calculated formula	C32 H56 N3 P Si3
SMILES	[Si]12([N](=C(N1C(C)(C)C)c1ccccc1)C(C)(C)C)N([Si](C)(C)C)[Si](P(C=2C12CC3CC(CC(C3)C1)C2)C)(C)C
Title of publication	Striking Stability of a Substituted Silicon(II) Bis(trimethylsilyl)amide and the Facile Si-Me Bond Cleavage without a Transition Metal Catalyst
Authors of publication	Sakya S. Sen; Jakob Hey; Regine Herbst-Irmer; Herbert W. Roesky; Dietmar Stalke
Journal of publication	Journal of the American Chemical Society
Year of publication	2011
Journal volume	133
Pages of publication	12311 - 12316
a	12.866 ± 0.002 Å
b	16.639 ± 0.002 Å
c	17.09 ± 0.003 Å
α	90.72 ± 0.02°
β	108.43 ± 0.03°
γ	91.82 ± 0.02°
Cell volume	3468.2 ± 1.1 Å³
Cell temperature	101 ± 2 K
Ambient diffraction temperature	101 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0471
Residual factor for significantly intense reflections	0.0366
Weighted residual factors for significantly intense reflections	0.0937
Weighted residual factors for all reflections included in the refinement	0.0998
Goodness-of-fit parameter for all reflections included in the refinement	1.026
Diffraction radiation wavelength	0.56086 Å
Diffraction radiation type	AgKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
178811 (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 4/10/65.	4106537.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4106537.cif
53339	2012-04-19	cif/ Adding structures of 4106537 via cif-deposit CGI script.	4106537.cif