Crystallography Open Database

Information card for entry 7705701

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Coordinates	7705701.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C49 H110 K2 O12 Si9
Calculated formula	C49 H110 K2 O12 Si9
Title of publication	Long-range coupling in cyclic silanes.
Authors of publication	Ferguson, John T.; Jiang, Qifeng; Marro, Eric A.; Siegler, Maxime A.; Klausen, Rebekka S.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	42
Pages of publication	14951 - 14961
a	12.2789 ± 0.0003 Å
b	16.4703 ± 0.0003 Å
c	19.5884 ± 0.0004 Å
α	74.5249 ± 0.0019°
β	73.536 ± 0.002°
γ	87.0261 ± 0.0018°
Cell volume	3660.14 ± 0.14 Å³
Cell temperature	130 ± 2 K
Ambient diffraction temperature	130 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0614
Residual factor for significantly intense reflections	0.0464
Weighted residual factors for significantly intense reflections	0.1067
Weighted residual factors for all reflections included in the refinement	0.1149
Goodness-of-fit parameter for all reflections included in the refinement	1.058
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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