Information card for entry 4341075

Structure parameters

• Formula: C38 H34 B K P2
• Calculated formula: C38 H34 B K P2
• SMILES: P(c1ccccc1)(c1ccccc1)C[B](c1ccccc1)(CP(c1ccccc1)c1ccccc1)c1ccccc1.[K+]
• Title of publication: Addressing the chemical sorcery of "GaI": benefits of solid-state analysis aiding in the synthesis of P→Ga coordination compounds.
• Authors of publication: Malbrecht, Brian J.; Dube, Jonathan W.; Willans, Mathew J.; Ragogna, Paul J.
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 18
• Pages of publication: 9644 - 9656
• a: 16.5015 ± 0.0006 Å
• b: 17.282 ± 0.0006 Å
• c: 22.4294 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6396.4 ± 0.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.1005
• Residual factor for significantly intense reflections: 0.0771
• Weighted residual factors for significantly intense reflections: 0.211
• Weighted residual factors for all reflections included in the refinement: 0.2273
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No