Information card for entry 4308309

Structure parameters

• Formula: C118 H104 Br2 N2 O4 P4 Pd2
• Calculated formula: C118 H104 Br2 N2 O4 P4 Pd2
• Title of publication: Palladium Complexes of Perylene Diimides: Strong Fluorescence Despite Direct Attachment of Late Transition Metals to Organic Dyes
• Authors of publication: Haim Weissman; Elijah Shirman; Tal Ben-Moshe; Revital Cohen; Gregory Leitus; Linda J. W. Shimon; Boris Rybtchinski
• Journal of publication: Inorganic Chemistry
• Year of publication: 2007
• Journal volume: 46
• Pages of publication: 4790 - 4792
• a: 13.843 ± 0.003 Å
• b: 18.538 ± 0.004 Å
• c: 18.911 ± 0.004 Å
• α: 90°
• β: 96.61 ± 0.03°
• γ: 90°
• Cell volume: 4820.7 ± 1.8 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0756
• Residual factor for significantly intense reflections: 0.0454
• Weighted residual factors for significantly intense reflections: 0.1001
• Weighted residual factors for all reflections included in the refinement: 0.1088
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No