Information card for entry 2213817

Structure parameters

• Chemical name: Diazidobis(2,2'-biimidazole)nickel(II)
• Formula: C12 H12 N14 Ni
• Calculated formula: C12 H12 N14 Ni
• SMILES: c1c[nH]c2c3[n](cc[nH]3)[Ni]3([n]12)(N=N#N)([n]1cc[nH]c1c1[n]3cc[nH]1)N=N#N
• Title of publication: Diazidobis(2,2'-biimidazole)nickel(II)
• Authors of publication: Ni, Zhong-Hai; Cai, Zhi-Nan; Zhong, Wei-Feng; Wei, Shang-Zheng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 6
• Pages of publication: m1570 - m1570
• a: 12.6974 ± 0.0018 Å
• b: 8.8399 ± 0.001 Å
• c: 14.3537 ± 0.0012 Å
• α: 90°
• β: 91.803 ± 0.009°
• γ: 90°
• Cell volume: 1610.3 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0382
• Residual factor for significantly intense reflections: 0.0301
• Weighted residual factors for significantly intense reflections: 0.0648
• Weighted residual factors for all reflections included in the refinement: 0.0693
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes