Information card for entry 1557168

Structure parameters

• Common name: [Ta(BzNPy)2Cl3]
• Formula: C24 H22 Cl3 N4 Ta
• Calculated formula: C31 Cl3 N4 Ta
• SMILES: [Ta]12(Cl)(Cl)(Cl)([n]3c(N1Cc1ccccc1)cccc3)[n]1c(N2Cc2ccccc2)cccc1.Cc1ccccc1
• Title of publication: Syntheses and Crystal Structures of Bis[2-(benzylamido)pyridine]trichloro Complexes of Niobium(V) and Tantalum(V)
• Authors of publication: Polamo, Mika; Leskela, Markku
• Journal of publication: Acta Chemica Scandinavica
• Year of publication: 1997
• Journal volume: 51
• Pages of publication: 449 - 454
• a: 9.227 ± 0.008 Å
• b: 20.005 ± 0.007 Å
• c: 16.804 ± 0.006 Å
• α: 90°
• β: 100.08 ± 0.05°
• γ: 90°
• Cell volume: 3054 ± 3 ų
• Ambient diffraction temperature: 193 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0628
• Residual factor for significantly intense reflections: 0.0582
• Weighted residual factors for significantly intense reflections: 0.1588
• Weighted residual factors for all reflections included in the refinement: 0.1627
• Goodness-of-fit parameter for all reflections included in the refinement: 1.069
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No