Information card for entry 2234025

Structure parameters

• Chemical name: <i>catena</i>-Poly[[(1,10-phenanthroline)cobalt(II)]-di-μ-azido]
• Formula: C12 H8 Co N8
• Calculated formula: C12 H8 Co N8
• SMILES: [Co]123([N](=N#N)[Co]45([N]3=N#N)([N]#N=N[Co]3(N=N#N)([N]#N=N5)[n]5cccc6ccc7ccc[n]3c7c56)[n]3cccc5ccc6ccc[n]4c6c35)([N]#N=N[Co]3(N=N#N)([N]#N=N2)[n]2cccc4ccc5ccc[n]3c5c24)[n]2cccc3ccc4ccc[n]1c4c23
• Title of publication: <i>catena</i>-Poly[[(1,10-phenanthroline)cobalt(II)]-di-μ-azido]
• Authors of publication: Gao, Xue-Miao; Zhao, Jiong-Peng; Liu, Fu-Chen
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 3
• Pages of publication: m318
• a: 7.0018 ± 0.0014 Å
• b: 10.049 ± 0.002 Å
• c: 10.491 ± 0.002 Å
• α: 109.83 ± 0.03°
• β: 103.63 ± 0.03°
• γ: 105.78 ± 0.03°
• Cell volume: 622.8 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.085
• Residual factor for significantly intense reflections: 0.0522
• Weighted residual factors for significantly intense reflections: 0.091
• Weighted residual factors for all reflections included in the refinement: 0.1011
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes