Information card for entry 4085080

Structure parameters

• Formula: C40 H26 F24 Ge2 O4
• Calculated formula: C40 H26 F24 Ge2 O4
• SMILES: [Ge]12([Ge]34(OC(c5c3ccc(c5)C)(C(F)(F)F)C(F)(F)F)[OH]C(c3c4ccc(c3)C)(C(F)(F)F)C(F)(F)F)(OC(c3c1ccc(c3)C)(C(F)(F)F)C(F)(F)F)[OH]C(c1c2ccc(c1)C)(C(F)(F)F)C(F)(F)F
• Title of publication: Interconversion among Dianionic, Anionic, and Neutral Compounds Bearing a Bond between Two Pentacoordinated Germanium Atoms
• Authors of publication: Kano, Naokazu; Tsukada, Satoru; Shibata, Yusuke; Kawashima, Takayuki; Sato, Hiroyasu; Guo, Jing-Dong; Nagase, Shigeru
• Journal of publication: Organometallics
• Year of publication: 2015
• Journal volume: 34
• Journal issue: 1
• Pages of publication: 56
• a: 11.4038 ± 0.0004 Å
• b: 11.2214 ± 0.0003 Å
• c: 17.0504 ± 0.0004 Å
• α: 90°
• β: 96.072 ± 0.007°
• γ: 90°
• Cell volume: 2169.64 ± 0.11 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for significantly intense reflections: 0.0439
• Weighted residual factors for all reflections included in the refinement: 0.1343
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No