Crystallography Open Database

Information card for entry 7103371

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Coordinates	7103371.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C85 H229 Ge20 Li3 O7 Si19
Calculated formula	C84.99 H229.05 Ge20 Li3 O6.99 Si19
Title of publication	Ge(14)[Ge(SiMe(3))(3)](5)Li(3)(THF)(6): the largest metalloid cluster compound of germanium: on the way to fullerene-like compounds?
Authors of publication	Schenk, Christian; Schnepf, Andreas
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2008
Journal issue	38
Pages of publication	4643 - 4645
a	20.3002 ± 0.001 Å
b	20.3002 ± 0.001 Å
c	22.1 ± 0.002 Å
α	90°
β	90°
γ	120°
Cell volume	7887 ± 0.9 Å³
Cell temperature	149 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
Space group number	176
Hermann-Mauguin space group symbol	P 63/m
Hall space group symbol	-P 6c
Residual factor for all reflections	0.0567
Residual factor for significantly intense reflections	0.0457
Weighted residual factors for significantly intense reflections	0.112
Weighted residual factors for all reflections included in the refinement	0.1161
Goodness-of-fit parameter for all reflections included in the refinement	1.067
Diffraction radiation wavelength	0.8 Å
Diffraction radiation type	synchrotron
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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