Information card for entry 2208071

Structure parameters

• Chemical name: catena-Poly[[bis(1,1'-butane-1,4-diyldiimidazole-κN^3^)nickel(II)]-μ- 1,1'-butane-1,4-diyldiimidazole-κ^2^N^3^:N^3'^]
• Formula: C22 H28 N10 Ni S2
• Calculated formula: C22 H28 N10 Ni S2
• SMILES: [Ni]1(N=C=S)(N=C=S)([n]2ccn(c2)CCCCn2c[n](cc2)[Ni](N=C=S)(N=C=S)[n]2cn(cc2)CCCCn2c[n]1cc2)([n]1cn(cc1)CCCCn1cncc1)[n]1cn(cc1)CCCCn1cncc1
• Title of publication: <i>catena</i>-Poly[[bis(1,1'-butane-1,4-diyldiimidazole-κ<i>N</i>^3^)nickel(II)]-μ-1,1'-butane-1,4-diyldiimidazole-κ^2^<i>N</i>^3^:<i>N</i>^3'^], a one-dimensional coordination polymer
• Authors of publication: Guang-Bo Che; Hong Liu; Chun-Bo Liu; Bo Liu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 2
• Pages of publication: m286 - m288
• a: 8.9269 ± 0.0004 Å
• b: 9.659 ± 0.0005 Å
• c: 14.439 ± 0.0008 Å
• α: 90°
• β: 91.073 ± 0.004°
• γ: 90°
• Cell volume: 1244.78 ± 0.11 ų
• Cell temperature: 292 ± 2 K
• Ambient diffraction temperature: 292 ± 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: 0.0477
• Residual factor for significantly intense reflections: 0.033
• Weighted residual factors for significantly intense reflections: 0.0731
• Weighted residual factors for all reflections included in the refinement: 0.083
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes