Crystallography Open Database

Information card for entry 4074929

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Coordinates	4074929.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H30 S6 Si2
Calculated formula	C42 H30 S6 Si2
Title of publication	Synthesis of π-Conjugated Oligomers Containing Dithienosilole Units
Authors of publication	Kim, Dong-Ha; Ohshita, Joji; Lee, Kwang-Hoi; Kunugi, Yoshihito; Kunai, Atsutaka
Journal of publication	Organometallics
Year of publication	2006
Journal volume	25
Journal issue	6
Pages of publication	1511 - 1516
a	9.3886 ± 0.0005 Å
b	10.5077 ± 0.0001 Å
c	12.4065 ± 0.0006 Å
α	68.413 ± 0.002°
β	81.359 ± 0.005°
γ	83.288 ± 0.003°
Cell volume	1122.64 ± 0.08 Å³
Cell temperature	223.1 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for significantly intense reflections	0.079
Weighted residual factors for all reflections included in the refinement	0.157
Goodness-of-fit parameter for all reflections included in the refinement	17.068
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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