Information card for entry 4338101

Structure parameters

• Formula: C32 H45 Cu3 I3 N9 O
• Calculated formula: C32 H45 Cu3 I3 N9 O
• Title of publication: Single-Step Substitution of all the α, β-Positions in Pyrrole: Choice of Binuclear versus Multinuclear Complex of the Novel Polydentate Ligand.
• Authors of publication: Ghorai, Debasish; Mani, Ganesan
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 8
• Pages of publication: 4117 - 4129
• a: 11.508 ± 0.0013 Å
• b: 12.0734 ± 0.0014 Å
• c: 16.0273 ± 0.0018 Å
• α: 88.789 ± 0.004°
• β: 79.613 ± 0.003°
• γ: 71.175 ± 0.003°
• Cell volume: 2071.5 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.0715
• Residual factor for significantly intense reflections: 0.0377
• Weighted residual factors for significantly intense reflections: 0.0926
• Weighted residual factors for all reflections included in the refinement: 0.1162
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No