Information card for entry 7050600

Structure parameters

• Formula: C36 H46 N4 Ni Si2
• Calculated formula: C36 H46 N4 Ni Si2
• SMILES: [Ni]12([N](=C(N1[Si](C)(C)C)c1ccccc1)c1c(cccc1C)C)[N](=C(N2[Si](C)(C)C)c1ccccc1)c1c(cccc1C)C
• Title of publication: Synthesis and structural characterisation of divalent transition metal complexes containing an unsymmetrical benzamidinate ligandElectronic supplementary information (ESI) available: inclination angles in complexes 1?6. See http://www.rsc.org/suppdata/nj/b3/b303527a//
• Authors of publication: Kay Lee, Hung; Suet Lam, Tung; Lam, Chi-Keung; Li, Hung-Wing; Man Fung, Sze
• Journal of publication: New Journal of Chemistry
• Year of publication: 2003
• Journal volume: 27
• Journal issue: 9
• Pages of publication: 1310
• a: 12.3641 ± 0.0009 Å
• b: 12.4981 ± 0.0009 Å
• c: 14.4849 ± 0.0011 Å
• α: 97.98 ± 0.001°
• β: 109.071 ± 0.002°
• γ: 114.916 ± 0.001°
• Cell volume: 1816 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.056
• Residual factor for significantly intense reflections: 0.0404
• Weighted residual factors for significantly intense reflections: 0.1161
• Weighted residual factors for all reflections included in the refinement: 0.1241
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No