Information card for entry 2218894

Structure parameters

• Chemical name: <i>catena</i>-Poly[[bis(3-benzoylpyridine-κ<i>N</i>)zinc(II)]- di-μ-dicyanamido-κ^4^<i>N</i>^1^:<i>N</i>^5^]
• Formula: C28 H18 N8 O2 Zn
• Calculated formula: C28 H18 N8 O2 Zn
• SMILES: [Zn]1([n]2cccc(c2)C(=O)c2ccccc2)([n]2cccc(c2)C(=O)c2ccccc2)([N]#CN=C=N[Zn]([n]2cccc(c2)C(=O)c2ccccc2)([n]2cccc(c2)C(=O)c2ccccc2)[N]#CN=C=N1)(N=C=NC#N)N=C=NC#N
• Title of publication: <i>catena</i>-Poly[[bis(3-benzoylpyridine-κ<i>N</i>)zinc(II)]-di-μ-dicyanamido-κ^4^<i>N</i>^1^:<i>N</i>^5^]
• Authors of publication: Yu, Fei; Li, Zhong-Shu; Sun, Bai-Wang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 8
• Pages of publication: m993
• a: 6.463 ± 0.004 Å
• b: 7.49 ± 0.004 Å
• c: 26.3 ± 0.015 Å
• α: 90°
• β: 98.399 ± 0.016°
• γ: 90°
• Cell volume: 1259.5 ± 1.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0646
• Residual factor for significantly intense reflections: 0.0496
• Weighted residual factors for significantly intense reflections: 0.1206
• Weighted residual factors for all reflections included in the refinement: 0.1291
• Goodness-of-fit parameter for all reflections included in the refinement: 1.087
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes