Information card for entry 2204849

Structure parameters

• Formula: C24 H32 Cl2 N8 Ni
• Calculated formula: C24 H32 Cl2 N8 Ni
• SMILES: c1cccc(c1[NH2][Ni]12([NH2]c3ccccc3[NH2]1)([NH2]c1ccccc1[NH2]2)[NH2]c1ccccc1N)N.[Cl-].[Cl-]
• Title of publication: Tetrakis(1,2-diaminobenzene)-κ^2^<i>N</i>;κ^4^<i>N,N</i>'-nickel(II) dichloride
• Authors of publication: W. G. Piyal Ariyananda; Richard E. Norman
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 1
• Pages of publication: m187 - m189
• a: 12.8062 ± 0.0007 Å
• b: 8.1242 ± 0.0004 Å
• c: 12.4333 ± 0.0008 Å
• α: 90°
• β: 100.61 ± 0.002°
• γ: 90°
• Cell volume: 1271.45 ± 0.12 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 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: 0.0681
• Residual factor for significantly intense reflections: 0.0625
• Weighted residual factors for all reflections: 0.1258
• Weighted residual factors for all reflections included in the refinement: 0.1097
• Goodness-of-fit parameter for all reflections: 0.9827
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0224
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes