Information card for entry 2225964

Structure parameters

• Chemical name: Tetrakis(8-quinolinolato-κ^2^<i>N</i>,<i>O</i>)hafnium(IV) dimethylformamide solvate monohydrate
• Formula: C39 H33 Hf N5 O6
• Calculated formula: C39 H33 Hf N5 O6
• SMILES: c1ccc2cccc3c2[n]1[Hf]124([n]5cccc6cccc(c56)O1)([n]1cccc5cccc(c15)O2)([n]1cccc2cccc(c12)O4)O3.CN(C=O)C.O
• Title of publication: Tetrakis(8-quinolinolato-κ^2^<i>N</i>,<i>O</i>)hafnium(IV) dimethylformamide solvate monohydrate
• Authors of publication: Viljoen, Johannes A.; Visser, Hendrik G.; Roodt, Andreas
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 5
• Pages of publication: m603 - m604
• a: 11.36 ± 0.005 Å
• b: 12.245 ± 0.004 Å
• c: 12.504 ± 0.005 Å
• α: 91.817 ± 0.004°
• β: 103.333 ± 0.005°
• γ: 99.19 ± 0.005°
• Cell volume: 1666.5 ± 1.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0233
• Residual factor for significantly intense reflections: 0.0216
• Weighted residual factors for all reflections included in the refinement: 0.053
• Goodness-of-fit parameter for all reflections included in the refinement: 1.077
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes