Information card for entry 2220077

Structure parameters

• Chemical name: Triazido[tris(2-pyridyl-κN)methylamine]cobalt(III)
• Formula: C16 H14 Co N13
• Calculated formula: C16 H14 Co N13
• SMILES: [Co]12([n]3ccccc3C(c3cccc[n]13)(c1cccc[n]21)N)(N=N#N)(N=N#N)N=N#N
• Title of publication: Triazido[tris(2-pyridyl-κ<i>N</i>)methylamine]cobalt(III)
• Authors of publication: Hao, Lujiang; Liu, Xia
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 12
• Pages of publication: m1499
• a: 10.2063 ± 0.0003 Å
• b: 13.676 ± 0.0006 Å
• c: 14.4735 ± 0.0002 Å
• α: 68.15 ± 0.003°
• β: 77.114 ± 0.002°
• γ: 80.249 ± 0.002°
• Cell volume: 1819.53 ± 0.11 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0343
• Residual factor for significantly intense reflections: 0.0286
• Weighted residual factors for significantly intense reflections: 0.0812
• Weighted residual factors for all reflections included in the refinement: 0.0865
• Goodness-of-fit parameter for all reflections included in the refinement: 0.999
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes