Crystallography Open Database

Information card for entry 7242916

Preview

Coordinates	7242916.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H38 S2 Si2
Calculated formula	C28 H38 S2 Si2
SMILES	c1(c2cccc(c2cs1)c1cccc2c(scc12)[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C
Title of publication	Synthesis, optical and electrochemical properties of 4,4′-bibenzo[c]thiophene derivatives
Authors of publication	Obayashi, Kotaro; Imato, Keiichi; Aoyama, Satoshi; Enoki, Toshiaki; Akiyama, Seiji; Ishida, Mio; Suga, Seiji; Mitsudo, Koichi; Ooyama, Yousuke
Journal of publication	RSC Advances
Year of publication	2021
Journal volume	11
Journal issue	31
Pages of publication	18870 - 18880
a	17.6427 ± 0.0009 Å
b	11.2395 ± 0.0006 Å
c	14.1794 ± 0.0007 Å
α	90°
β	95.121 ± 0.001°
γ	90°
Cell volume	2800.5 ± 0.2 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 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	0.0343
Residual factor for significantly intense reflections	0.0292
Weighted residual factors for significantly intense reflections	0.0711
Weighted residual factors for all reflections included in the refinement	0.0743
Goodness-of-fit parameter for all reflections included in the refinement	0.955
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKa
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
265497 (current)	2021-05-26	cif/ Adding structures of 7242916, 7242917 via cif-deposit CGI script.	7242916.cif