Crystallography Open Database

Information card for entry 4101981

4101980 << 4101981 >> 4101982

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Coordinates	4101981.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C74 H162 O2 Si16
Calculated formula	C74 H162 O2 Si16
Title of publication	Reactivity of an Aryl-Substituted Silicon-Silicon Triple Bond: Reactions of a 1,2-Diaryldisilyne with Alkenes
Authors of publication	Joon Soo Han; Takahiro Sasamori; Yoshiyuki Mizuhata; Norihiro Tokitoh
Journal of publication	Journal of the American Chemical Society
Year of publication	2010
Journal volume	132
Pages of publication	2546 - 2547
a	12.2291 ± 0.0001 Å
b	13.0394 ± 0.0002 Å
c	16.4212 ± 0.0003 Å
α	94.7085 ± 0.0008°
β	106.87 ± 0.0006°
γ	104.595 ± 0.0006°
Cell volume	2390.68 ± 0.06 Å³
Cell temperature	103 ± 2 K
Ambient diffraction temperature	103 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 all reflections	0.0388
Residual factor for significantly intense reflections	0.0358
Weighted residual factors for significantly intense reflections	0.0965
Weighted residual factors for all reflections included in the refinement	0.0994
Goodness-of-fit parameter for all reflections included in the refinement	1.02
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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