Crystallography Open Database

Information card for entry 1556587

Preview

Coordinates	1556587.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C33 H58 Si7
Calculated formula	C33 H58 Si7
SMILES	c1(c2ccccc2cc2ccccc12)[Si]1=[Si]([Si](C)(C)C)C([Si](C)(C)C)([Si](C)(C)C)CCC1([Si](C)(C)C)[Si](C)(C)C
Title of publication	Synthesis and Functionalization of a 1,2-Bis(trimethylsilyl)-1,2-disilacyclohexene That Can Serve as a Unit of cis-1,2-Dialkyldisilene
Authors of publication	Akasaka, N.; Tanaka, K.; Ishida, S.; Iwamoto, T.
Journal of publication	Inorganics
Year of publication	2018
Journal volume	6
Pages of publication	21
a	17.7493 ± 0.0008 Å
b	9.0323 ± 0.0004 Å
c	23.7624 ± 0.001 Å
α	90°
β	91.283 ± 0.001°
γ	90°
Cell volume	3808.6 ± 0.3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	3
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.037
Residual factor for significantly intense reflections	0.032
Weighted residual factors for significantly intense reflections	0.0808
Weighted residual factors for all reflections included in the refinement	0.0847
Goodness-of-fit parameter for all reflections included in the refinement	1.038
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
245207 (current)	2019-12-16	cif/ Adding structures of 1556587 via cif-deposit CGI script.	1556587.cif