Crystallography Open Database

Information card for entry 7102340

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Coordinates	7102340.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C31 H63 K O Si6 Sn
Calculated formula	C31.02 H63 K O Si6 Sn
Title of publication	Ansa-tris(allyl) complexes of alkali metals: tripodal analogues of cyclopentadienyl and ansa-metallocene ligands.
Authors of publication	Layfield, Richard A; García, Felipe; Hannauer, Julien; Humphrey, Simon M
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2007
Journal issue	47
Pages of publication	5081 - 5083
a	17.4815 ± 0.0009 Å
b	17.4815 ± 0.0009 Å
c	27.596 ± 0.002 Å
α	90°
β	90°
γ	120°
Cell volume	7303.5 ± 0.8 Å³
Cell temperature	180 ± 2 K
Ambient diffraction temperature	180 ± 2 K
Number of distinct elements	6
Space group number	161
Hermann-Mauguin space group symbol	R 3 c :H
Hall space group symbol	R 3 -2"c
Residual factor for all reflections	0.0482
Residual factor for significantly intense reflections	0.0312
Weighted residual factors for significantly intense reflections	0.0685
Weighted residual factors for all reflections included in the refinement	0.0773
Goodness-of-fit parameter for all reflections included in the refinement	1.06
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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