Information card for entry 7120762

Structure parameters

• Formula: C66.5 H47.5 N4 O4 Th
• Calculated formula: C66.5 H47.5 N4 O4 Th
• Title of publication: Th(IV) and Ce(IV) Napthylsalophen Sandwich Complexes: Characterization of Unusual Thorium Fluorescence in Solution and Solid-state
• Authors of publication: Hardy, Emily Elizabeth; Wyss, Kevin M.; Gorden, John D.; Ariyarathna, Isuru R.; Miliordos, Evangelos; Gorden, Anne E. V.
• Journal of publication: Chem. Commun.
• Year of publication: 2017
• a: 11.4987 ± 0.0003 Å
• b: 14.3617 ± 0.0004 Å
• c: 16.2769 ± 0.0005 Å
• α: 106.221 ± 0.0011°
• β: 90.8257 ± 0.0011°
• γ: 94.1515 ± 0.0011°
• Cell volume: 2572.52 ± 0.13 ų
• Cell temperature: 180.45 K
• Ambient diffraction temperature: 180.45 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: 0.0454
• Residual factor for significantly intense reflections: 0.0305
• Weighted residual factors for significantly intense reflections: 0.0547
• Weighted residual factors for all reflections included in the refinement: 0.0582
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0413
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No