Information card for entry 7019194

Structure parameters

• Formula: C49 H60 N4 Nb P3
• Calculated formula: C49 H60 N4 Nb P3
• SMILES: [Nb](N(C(C)C)P(c1ccccc1)c1ccccc1)(N(C(C)C)P(c1ccccc1)c1ccccc1)(N(C(C)C)P(c1ccccc1)c1ccccc1)=NC(C)(C)C
• Title of publication: Synthesis and investigation of the metal-metal interactions in early/late heterobimetallic complexes linking group 5 imido fragments to Co(i).
• Authors of publication: Evers, Deirdra A.; Bluestein, Alia H.; Foxman, Bruce M.; Thomas, Christine M.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 26
• Pages of publication: 8111 - 8115
• a: 11.5194 ± 0.0007 Å
• b: 12.7582 ± 0.0008 Å
• c: 16.2521 ± 0.001 Å
• α: 85.882 ± 0.003°
• β: 84.414 ± 0.003°
• γ: 76.135 ± 0.003°
• Cell volume: 2305 ± 0.2 ų
• Cell temperature: 120 K
• Ambient diffraction temperature: 120 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: 0.0437
• Residual factor for significantly intense reflections: 0.0317
• Weighted residual factors for all reflections: 0.0733
• Weighted residual factors for significantly intense reflections: 0.0683
• Weighted residual factors for all reflections included in the refinement: 0.0733
• Goodness-of-fit parameter for all reflections included in the refinement: 0.9839
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No