Information card for entry 1570324

Structure parameters

• Formula: C49 H36 F4 Ge O3 P2 S
• Calculated formula: C49 H36 F4 Ge O3 P2 S
• SMILES: [Ge]1(c2ccc3c4c(ccc([P]1(c1ccccc1)c1ccccc1)c24)CC3)(F)c1ccc2c3c(ccc([P](c4ccccc4)c4ccccc4)c13)CC2.O=S(=O)([O-])C(F)(F)F
• Title of publication: Intramolecular donor-stabilized tetra-coordinated germanium(iv) di-cations and their Lewis acidic properties.
• Authors of publication: Peddi, Balakrishna; Khan, Souvik; Gonnade, Rajesh G.; Yildiz, Cem B.; Majumdar, Moumita
• Journal of publication: Chemical science
• Year of publication: 2023
• Journal volume: 14
• Journal issue: 47
• Pages of publication: 13755 - 13764
• a: 10.046 ± 0.003 Å
• b: 18.494 ± 0.006 Å
• c: 23.535 ± 0.008 Å
• α: 90°
• β: 97.484 ± 0.012°
• γ: 90°
• Cell volume: 4335 ± 2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0776
• Residual factor for significantly intense reflections: 0.0441
• Weighted residual factors for significantly intense reflections: 0.0998
• Weighted residual factors for all reflections included in the refinement: 0.1135
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No