Crystallography Open Database

Information card for entry 4124370

Preview

Coordinates	4124370.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C29 H56 N2 O2 Si4 W
Calculated formula	C29 H56 N2 O2 Si4 W
SMILES	[WH]1234(C#[O])(C#[O])([c]5([c]4([c]3([c]2([c]15C)C)C)C)C)[SiH](c1n(c(c([n+]1C)C)C)C)C([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C
Title of publication	Unexpected Formation of NHC-Stabilized Hydrosilylyne Complexes via Alkane Elimination from NHC-Stabilized Hydrido(alkylsilylene) Complexes.
Authors of publication	Fukuda, Tetsuya; Hashimoto, Hisako; Tobita, Hiromi
Journal of publication	Journal of the American Chemical Society
Year of publication	2015
Journal volume	137
Journal issue	34
Pages of publication	10906 - 10909
a	9.407 ± 0.001 Å
b	11.2192 ± 0.0012 Å
c	17.9488 ± 0.0019 Å
α	103.741 ± 0.007°
β	94.638 ± 0.007°
γ	104.367 ± 0.007°
Cell volume	1762.8 ± 0.3 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0356
Residual factor for significantly intense reflections	0.0295
Weighted residual factors for significantly intense reflections	0.0524
Weighted residual factors for all reflections included in the refinement	0.054
Goodness-of-fit parameter for all reflections included in the refinement	1.062
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176428 (current)	2016-02-13	Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively.	4124370.cif
154265	2015-09-04	cif/ Adding structures of 4124370 via cif-deposit CGI script.	4124370.cif