Information card for entry 8103142

Structure parameters

• Chemical name: [(2-(4-fluorophenyl)-1H-imidazo[4,5-f][1,10]phenanthroline-lead(II)]- 5-nitro-1,3-benzenedicarboxylato], [Pb(C~19~H~11~N~4~F)~2~(C~8~H~3~NO~6~)]^.^1.5H~2~O
• Formula: C92 H56 F4 N18 O15 Pb2
• Calculated formula: C92 H50 F4 N18 O15 Pb2
• Title of publication: Crystal structure of (2-(4-fluorophenyl)-1H-imidazo[4,5-f][1,10]-phenanthroline)-(5-nitro-1,3-benzenedicarboxylato)lead(II) sesquihydrate, Pb(C19H11N4F)2(C8H3NO6) · 1.5H2O
• Authors of publication: Xiu-Yan Wang; Shuai Ma; Yu He
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2011
• Journal volume: 226
• Journal issue: 3
• Pages of publication: 350
• a: 18.2901 ± 0.001 Å
• b: 10.6611 ± 0.0006 Å
• c: 20.8722 ± 0.0011 Å
• α: 90°
• β: 100.122 ± 0.001°
• γ: 90°
• Cell volume: 4006.6 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.0543
• Residual factor for significantly intense reflections: 0.039
• Weighted residual factors for significantly intense reflections: 0.0904
• Weighted residual factors for all reflections included in the refinement: 0.096
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No