Information card for entry 1570323

Structure parameters

• Formula: C47 H58 Cl4 F6 Ge N2 O6 P2 S2
• Calculated formula: C47 H58 Cl4 F6 Ge N2 O6 P2 S2
• SMILES: [Ge]12(c3ccc4c5c(ccc([P]1(C(C)C)C(C)C)c35)CC4)([P](c1ccc3c4c(ccc2c14)CC3)(C(C)C)C(C)C)[n]1ccc(N(C)C)cc1.S(=O)(=O)([O-])C(F)(F)F.S(=O)(=O)([O-])C(F)(F)F.ClCCl.ClCCl
• 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: 11.282 ± 0.011 Å
• b: 30.08 ± 0.03 Å
• c: 15.527 ± 0.016 Å
• α: 90°
• β: 102.04 ± 0.03°
• γ: 90°
• Cell volume: 5153 ± 9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 9
• 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: 0.1293
• Residual factor for significantly intense reflections: 0.0933
• Weighted residual factors for significantly intense reflections: 0.2238
• Weighted residual factors for all reflections included in the refinement: 0.2506
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No