Information card for entry 2225249

Structure parameters

• Chemical name: <i>catena</i>-Poly[[(dimethylformamide-κ<i>O</i>)cobalt(II)]-bis[μ-(4- nitrophenyl)cyanamido]- κ^2^<i>N</i>^1^:<i>N</i>^3^;κ^2^<i>N</i>^3^:<i>N</i>^1^]
• Formula: C17 H15 Co N7 O5
• Calculated formula: C17 H15 Co N7 O5
• SMILES: [Co]1([N]#C[N-]c2ccc(cc2)N(=O)=O)(N(c2ccc(cc2)N(=O)=O)C#N)([O]=CN(C)C)N(c2ccc(cc2)N(=O)=O)C#[N][Co](N(c2ccc(cc2)N(=O)=O)C#[N]1)[O]=CN(C)C
• Title of publication: <i>catena</i>-Poly[[(dimethylformamide-κ<i>O</i>)cobalt(II)]-bis[μ-(4-nitrophenyl)cyanamido]-κ^2^<i>N</i>^1^:<i>N</i>^3^;κ^2^<i>N</i>^3^:<i>N</i>^1^]
• Authors of publication: Chiniforoshan, Hossein; Shirinfar, Bahare; Jalilpour, Soghra; Khavasi, Hamid Reza
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 3
• Pages of publication: m331
• a: 21.8692 ± 0.0016 Å
• b: 8.8517 ± 0.0006 Å
• c: 9.9827 ± 0.0008 Å
• α: 90°
• β: 100.151 ± 0.006°
• γ: 90°
• Cell volume: 1902.2 ± 0.2 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0696
• Residual factor for significantly intense reflections: 0.0516
• Weighted residual factors for significantly intense reflections: 0.0979
• Weighted residual factors for all reflections included in the refinement: 0.1039
• Goodness-of-fit parameter for all reflections included in the refinement: 1.195
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes