Crystallography Open Database

Information card for entry 4131638

Preview

Coordinates	4131638.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H72 Sb2 Si8
Calculated formula	C32 H72 Sb2 Si8
SMILES	C12(C(C(=C1[Si](C)(C)C)[Si](C)(C)C)([Sb]2[Sb]1C2(C1(C(=C2[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C
Title of publication	Bis(stibahousene).
Authors of publication	Lee, Vladimir Ya; Ota, Kei; Ito, Yuki; Gapurenko, Olga A.; Sekiguchi, Akira; Minyaev, Ruslan M.; Minkin, Vladimir I.; Gornitzka, Heinz
Journal of publication	Journal of the American Chemical Society
Year of publication	2017
Journal volume	139
Journal issue	39
Pages of publication	13897 - 13902
a	27.518 ± 0.004 Å
b	9.3225 ± 0.0013 Å
c	19.913 ± 0.003 Å
α	90°
β	109.766 ± 0.001°
γ	90°
Cell volume	4807.4 ± 1.2 Å³
Cell temperature	150 K
Ambient diffraction temperature	150 K
Number of distinct elements	4
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	0.0418
Residual factor for significantly intense reflections	0.0413
Weighted residual factors for significantly intense reflections	0.0943
Weighted residual factors for all reflections included in the refinement	0.0945
Goodness-of-fit parameter for all reflections included in the refinement	1.296
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
241814 (current)	2019-11-25	cif/ Adding structures of 4131638 via cif-deposit CGI script.	4131638.cif