Information card for entry 8106491

Structure parameters

• Formula: C22 H18 N7 O5 Pb
• Calculated formula: C22 H18 N7 O5 Pb
• SMILES: [Pb]123(OC(=O)c4cnccc4)(ON(=[O]1)=O)N(Cc1[n]2c2c([nH]1)cccc2)Cc1[n]3c2c([nH]1)cccc2
• Title of publication: Synthesis and crystal structure of catena-poly[(μ2-nicotinato-κ2 O,O′: κ1 N)-(nitrato-κ1 O)-(bis(2-benzimidazol-ylmethyl)amine-κ3 N,N′,N′′)lead(II)], C22H18N7O5Pb
• Authors of publication: Jia, Yan-hui; Huang, Fang-Fang; Peng, Mei-Hong; Nie, Feng-Mei
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2017
• Journal volume: 232
• Journal issue: 2
• Pages of publication: 227 - 229
• a: 7.7446 ± 0.0017 Å
• b: 16.914 ± 0.003 Å
• c: 17.726 ± 0.003 Å
• α: 72.451 ± 0.006°
• β: 86.9 ± 0.006°
• γ: 88.098 ± 0.007°
• Cell volume: 2210.3 ± 0.7 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 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: 0.0547
• Residual factor for significantly intense reflections: 0.0379
• Weighted residual factors for significantly intense reflections: 0.0711
• Weighted residual factors for all reflections included in the refinement: 0.0751
• Goodness-of-fit parameter for all reflections included in the refinement: 1.002
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No