Information card for entry 1543300

Structure parameters

• Formula: C43 H64 Cl3 Ga Ge N4 O3 Te
• Calculated formula: C43 H64 Cl3 Ga Ge N4 O3 Te
• SMILES: [Te]([Ge]1=C2N(C=CN2CN2C=1N(C=C2)c1c(cccc1C(C)C)C(C)C)c1c(cccc1C(C)C)C(C)C)[Ga](Cl)(Cl)Cl.O1CCCC1.O1CCCC1.O1CCCC1
• 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: 11.3788 ± 0.0003 Å
• b: 13.0772 ± 0.0003 Å
• c: 17.5125 ± 0.0004 Å
• α: 69.253 ± 0.002°
• β: 83.744 ± 0.002°
• γ: 84.543 ± 0.002°
• Cell volume: 2417.94 ± 0.11 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0623
• Residual factor for significantly intense reflections: 0.056
• Weighted residual factors for significantly intense reflections: 0.1475
• Weighted residual factors for all reflections included in the refinement: 0.1531
• Goodness-of-fit parameter for all reflections included in the refinement: 1.086
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No