Information card for entry 7008351

Structure parameters

• Formula: C46 H56 Cl4 In2 O6 P2
• Calculated formula: C46 H56 Cl4 In2 O6 P2
• SMILES: [OH2][In]12(Cl)([O](c3ccc(cc3[P]2(c2ccccc2)c2ccccc2)C)[In]2([O]1c1ccc(cc1[P]2(c1ccccc1)c1ccccc1)C)([OH2])(Cl)Cl)Cl.O(CC)CC.O(CC)CC
• Title of publication: Coordination chemistry of P, O-bidentate phosphinophenolates with Ga3+ and In3+.
• Authors of publication: Saatchi, Katayoun; Patrick, Brian O.; Orvig, Chris
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2005
• Journal issue: 13
• Pages of publication: 2268 - 2274
• a: 10.332 ± 0.0004 Å
• b: 10.5387 ± 0.0004 Å
• c: 12.722 ± 0.002 Å
• α: 105.611 ± 0.002°
• β: 103.913 ± 0.002°
• γ: 103.526 ± 0.002°
• Cell volume: 1227.2 ± 0.2 ų
• Cell temperature: 173.2 K
• Ambient diffraction temperature: 173.2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0428
• Residual factor for significantly intense reflections: 0.024
• Weighted residual factors for all reflections: 0.068
• Weighted residual factors for all reflections included in the refinement: 0.068
• Goodness-of-fit parameter for all reflections: 1.107
• Goodness-of-fit parameter for all reflections included in the refinement: 1.107
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No