Information card for entry 7708857

Structure parameters

• Formula: C28 H26 Cl2 F6 Ge O3 P2 S
• Calculated formula: C28 H26 Cl2 F6 Ge O3 P2 S
• SMILES: [Ge]1([P](CC[P]1(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)(F)(F)(F)OS(=O)(=O)C(F)(F)F.ClCCl
• Title of publication: Neutral and cationic germanium(IV) fluoride complexes with phosphine coordination – synthesis, spectroscopy and structures
• Authors of publication: King, Rhys; Levason, William; Reid, Gillian
• Journal of publication: Dalton Transactions
• Year of publication: 2021
• a: 10.2278 ± 0.00019 Å
• b: 12.3841 ± 0.0002 Å
• c: 12.2598 ± 0.0002 Å
• α: 90°
• β: 94.8064 ± 0.0016°
• γ: 90°
• Cell volume: 1547.39 ± 0.05 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 K
• Number of distinct elements: 8
• Space group number: 7
• Hermann-Mauguin space group symbol: P 1 n 1
• Hall space group symbol: P -2yac
• Residual factor for all reflections: 0.0492
• Residual factor for significantly intense reflections: 0.0393
• Weighted residual factors for significantly intense reflections: 0.0649
• Weighted residual factors for all reflections included in the refinement: 0.0688
• Goodness-of-fit parameter for all reflections included in the refinement: 1.015
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No