Information card for entry 4305304

Structure parameters

• Formula: C36 H30 In N7 O9
• Calculated formula: C36 H30 In N7 O9
• SMILES: N12CCNC(=O)C3=Cc4ccccc4C4=[O][In]56(ON34)(ON3C(C(=O)NCC1)=Cc1ccccc1C3=[O]5)ON1C(C(=O)NCC2)=Cc2ccccc2C1=[O]6
• Title of publication: Highly Fluorescent Group 13 Metal Complexes With Cyclic, Aromatic Hydroxamic Acid Ligands
• Authors of publication: Michael Seitz; Evan G. Moore; Kenneth N. Raymond
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 8665 - 8673
• a: 13.0384 ± 0.0015 Å
• b: 13.0384 ± 0.0015 Å
• c: 32.87 ± 0.008 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 4839.3 ± 1.4 ų
• Cell temperature: 169 ± 2 K
• Ambient diffraction temperature: 169 ± 2 K
• Number of distinct elements: 5
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.056
• Residual factor for significantly intense reflections: 0.0344
• Weighted residual factors for significantly intense reflections: 0.0706
• Weighted residual factors for all reflections included in the refinement: 0.0761
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No