Information card for entry 7054272

Structure parameters

• Formula: C30 H28 N12 O6 Pb2 S2
• Calculated formula: C30 H28 N12 O6 Pb2 S2
• Title of publication: Anion influence on transformations of a nonporous 3D to porous 3D coordination polymer
• Authors of publication: Hashemi, Lida; Morsali, Ali; Büyükgüngor, Orhan
• Journal of publication: New Journal of Chemistry
• Year of publication: 2014
• a: 7.806 ± 0.0004 Å
• b: 12.1582 ± 0.0006 Å
• c: 20.5067 ± 0.001 Å
• α: 90.072 ± 0.004°
• β: 91.404 ± 0.004°
• γ: 108.25 ± 0.004°
• Cell volume: 1847.69 ± 0.16 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0381
• Residual factor for significantly intense reflections: 0.0278
• Weighted residual factors for significantly intense reflections: 0.0626
• Weighted residual factors for all reflections included in the refinement: 0.0658
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No