Crystallography Open Database

Information card for entry 1576068

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Coordinates	1576068.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C62 H116 Ge3 N2 Si8
Calculated formula	C62 H116 Ge3 N2 Si8
Title of publication	A neutral homoaromatic heavy allene as a platform for selective conversion to a germylene-coordinated digermavinylidene
Authors of publication	Uchida, Daichi; Yamada, Hiroko; Mizuhata, Yoshiyuki
Journal of publication	Chemical Science
Year of publication	2025
a	12.6987 ± 0.0005 Å
b	16.2715 ± 0.0006 Å
c	19.6919 ± 0.0007 Å
α	93.615 ± 0.001°
β	97.189 ± 0.001°
γ	109.037 ± 0.001°
Cell volume	3792.6 ± 0.2 Å³
Cell temperature	90 ± 2 K
Ambient diffraction temperature	90 ± 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	0.0399
Residual factor for significantly intense reflections	0.0306
Weighted residual factors for significantly intense reflections	0.0764
Weighted residual factors for all reflections included in the refinement	0.0818
Goodness-of-fit parameter for all reflections included in the refinement	1.046
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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