Information card for entry 1543298

Structure parameters

• Formula: C39 H52 Cl3 Ga Ge N8
• Calculated formula: C39 H52 Cl3 Ga Ge N8
• SMILES: [Ge]1([Ga](Cl)(Cl)Cl)=C2N(C=CN2CN2C=1N(C=C2)c1c(cccc1C(C)C)C(C)C)c1c(cccc1C(C)C)C(C)C.N#CC.N#CC.N#CC.N#CC
• Title of publication: Heavier congeners of CO and CO2as ligands: from zero-valent germanium (‘germylone’) to isolable monomeric GeX and GeX2complexes (X = S, Se, Te)
• Authors of publication: Xiong, Yun; Yao, Shenglai; Karni, Miriam; Kostenko, Arseni; Burchert, Alexander; Apeloig, Yitzhak; Driess, Matthias
• Journal of publication: Chem. Sci.
• Year of publication: 2016
• Journal volume: 7
• Journal issue: 8
• Pages of publication: 5462
• a: 12.8149 ± 0.0004 Å
• b: 13.6703 ± 0.0004 Å
• c: 14.6341 ± 0.0004 Å
• α: 109.69 ± 0.003°
• β: 90.728 ± 0.002°
• γ: 112.29 ± 0.003°
• Cell volume: 2204.15 ± 0.14 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0493
• Residual factor for significantly intense reflections: 0.0458
• Weighted residual factors for significantly intense reflections: 0.1244
• Weighted residual factors for all reflections included in the refinement: 0.1268
• Goodness-of-fit parameter for all reflections included in the refinement: 1.092
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No