Information card for entry 7007729

Structure parameters

• Formula: C34 H36 Cl3 In N2 O
• Calculated formula: C34 H36 Cl3 In N2 O
• SMILES: C12C(c3cccc4cccc1c34)=[N](c1c(cc(cc1C)C)C)[In]([N]=2c1c(cc(cc1C)C)C)(Cl)(Cl)(Cl)[O]1CCCC1
• Title of publication: Complexes of 1,2-bis(aryl-imino)acenaphthene (Ar-BIAN) ligands with some heavy p-block elements.
• Authors of publication: Hill, Nicholas J.; Reeske, Gregor; Moore, Jennifer A.; Cowley, Alan H.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2006
• Journal issue: 40
• Pages of publication: 4838 - 4844
• a: 14.631 ± 0.005 Å
• b: 15.589 ± 0.005 Å
• c: 20.413 ± 0.005 Å
• α: 90°
• β: 93.09 ± 0.005°
• γ: 90°
• Cell volume: 4649 ± 2 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 6
• 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: 0.0718
• Residual factor for significantly intense reflections: 0.0519
• Weighted residual factors for significantly intense reflections: 0.142
• Weighted residual factors for all reflections included in the refinement: 0.1488
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No