Information card for entry 2232835

Structure parameters

• Chemical name: (Nitrato-κ<i>O</i>){<i>N</i>,<i>N</i>,<i>N'</i>,<i>N'</i>-tetrakis[(1<i>H</i>- benzimidazol-2-yl-κ<i>N</i>^3^)methyl]cyclohexane-1,2-diamine}lead(II) hemiaqua{<i>N</i>,<i>N</i>,<i>N'</i>,<i>N'</i>-tetrakis[(1<i>H</i>- benzimidazol-2-yl-κ<i>N</i>^3^)methyl]cyclohexane-1,2-diamine}lead(II) trinitrate dihydrate
• Formula: C76 H81 N24 O14.5 Pb2
• Calculated formula: C76 H81 N24 O14.5 Pb2
• Title of publication: (Nitrato-κ<i>O</i>){<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetrakis[(1<i>H</i>-benzimidazol-2-yl-κ<i>N</i>^3^)methyl]cyclohexane-1,2-diamine}lead(II) hemiaqua{<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetrakis[(1<i>H</i>-benzimidazol-2-yl-κ<i>N</i>^3^)methyl]cyclohexane-1,2-diamine}lead(II) trinitrate dihydrate
• Authors of publication: Xiao, Zuo-an; Jiang, Ting-ting
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 12
• Pages of publication: m1854 - m1855
• a: 12.5485 ± 0.0008 Å
• b: 18.5378 ± 0.0011 Å
• c: 19.2839 ± 0.0012 Å
• α: 64.516 ± 0.001°
• β: 81.957 ± 0.002°
• γ: 79.675 ± 0.001°
• Cell volume: 3973.9 ± 0.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.072
• Residual factor for significantly intense reflections: 0.0448
• Weighted residual factors for significantly intense reflections: 0.0889
• Weighted residual factors for all reflections included in the refinement: 0.1008
• Goodness-of-fit parameter for all reflections included in the refinement: 0.961
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes