Information card for entry 4318128

Structure parameters

• Chemical name: [3-(9-Anthroyl)pentane-1,3-dionato]bis(pentane-1,3-dionato)rhodium(iii)
• Formula: C30 H29 O7 Rh
• Calculated formula: C30 H29 O7 Rh
• SMILES: [Rh]123(OC(=CC(=[O]1)C)C)([O]=C(C)C=C(O2)C)[O]=C(C)C(=C(O3)C)C(=O)c1c2ccccc2cc2ccccc12
• Title of publication: Synthesis of Heteroleptic Anthryl-Substituted β-Ketoenolates of Rhodium(III) and Iridium(III): Photophysical, Electrochemical, and EPR Study of the Fluorophore-Metal Interaction
• Authors of publication: Maurizio Carano; Francesca Cicogna; Julien L. Houben; Giovanni Ingrosso; Fabio Marchetti; Loïc Mottier; Francesco Paolucci; Calogero Pinzino; Sergio Roffia
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 3396 - 3409
• a: 14.371 ± 0.002 Å
• b: 8.762 ± 0.002 Å
• c: 21.506 ± 0.003 Å
• α: 90°
• β: 100.19 ± 0.01°
• γ: 90°
• Cell volume: 2665.3 ± 0.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1948
• Residual factor for significantly intense reflections: 0.0772
• Weighted residual factors for significantly intense reflections: 0.108
• Weighted residual factors for all reflections included in the refinement: 0.143
• Goodness-of-fit parameter for all reflections included in the refinement: 0.996
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No