Crystallography Open Database

Information card for entry 7109741

Preview

Coordinates	7109741.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C66 H82 Ge6
Calculated formula	C66 H82 Ge6
SMILES	C(C)(C)[Ge](C(C)C)(C(C)C)[Ge](c1ccccc1)(c1ccccc1)[Ge](c1ccccc1)(c1ccccc1)[Ge](c1ccccc1)(c1ccccc1)[Ge](c1ccccc1)(c1ccccc1)[Ge](C(C)C)(C(C)C)C(C)C
Title of publication	A luminescent and dichroic hexagermane
Authors of publication	Kimberly D. Roewe; Arnold L. Rheingold; Charles S. Weinert
Journal of publication	Chem.Commun.
Year of publication	2013
Journal volume	49
Pages of publication	8380
a	11.0685 ± 0.0007 Å
b	11.3771 ± 0.0006 Å
c	12.7949 ± 0.0008 Å
α	97.447 ± 0.002°
β	91.495 ± 0.002°
γ	108.292 ± 0.002°
Cell volume	1513.09 ± 0.16 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	3
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0244
Residual factor for significantly intense reflections	0.0197
Weighted residual factors for significantly intense reflections	0.0472
Weighted residual factors for all reflections included in the refinement	0.0487
Goodness-of-fit parameter for all reflections included in the refinement	1.04
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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