Information card for entry 2206532

Structure parameters

• Chemical name: Diisothiocyanatotetrakis(1-methyl-1H-imidazole-κN^3^)nickel(II)
• Formula: C18 H24 N10 Ni S2
• Calculated formula: C18 H24 N10 Ni S2
• SMILES: [Ni]([n]1ccn(C)c1)([n]1ccn(C)c1)([n]1ccn(C)c1)([n]1ccn(C)c1)(N=C=S)N=C=S
• Title of publication: Diisothiocyanatotetrakis(1-methyl-1<i>H</i>-imidazole-κ<i>N</i>^3^)nickel(II)
• Authors of publication: Fa-Qian Liu; Fang-Fang Jian; Guang-Ye Liu; Lu-De Lu; Xu-Jie Yang; Xin Wang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 8
• Pages of publication: m1568 - m1570
• a: 11.002 ± 0.002 Å
• b: 15.3 ± 0.003 Å
• c: 14.309 ± 0.003 Å
• α: 90°
• β: 94.28 ± 0.03°
• γ: 90°
• Cell volume: 2401.9 ± 0.8 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: 0.1188
• Residual factor for significantly intense reflections: 0.0515
• Weighted residual factors for significantly intense reflections: 0.1369
• Weighted residual factors for all reflections included in the refinement: 0.1623
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes