Information card for entry 2007199

Structure parameters

• Formula: C32 H16 I N8 Sb
• Calculated formula: C32 H16 I N8 Sb
• SMILES: [I-].[Sb]123[n]4c5nc6[n]2c(nc2n1c(nc1[n]3c(nc4c4c5cccc4)c4c1cccc4)c1ccccc21)c1ccccc61
• Title of publication: (Phthalocyaninato)antimony Iodide
• Authors of publication: Kubiak, Ryszard; Razik, Mariola
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1998
• Journal volume: 54
• Journal issue: 4
• Pages of publication: 483 - 485
• a: 10.458 ± 0.002 Å
• b: 10.925 ± 0.002 Å
• c: 12.097 ± 0.002 Å
• α: 86.17 ± 0.03°
• β: 81.83 ± 0.03°
• γ: 76.31 ± 0.03°
• Cell volume: 1328.4 ± 0.5 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: 0.0862
• Residual factor for significantly intense reflections: 0.0387
• Weighted residual factors for all reflections: 0.1001
• Weighted residual factors for significantly intense reflections: 0.0859
• Goodness-of-fit parameter for all reflections: 0.985
• Goodness-of-fit parameter for significantly intense reflections: 1.081
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No