Information card for entry 4315674

Structure parameters

• Common name: NBD-dpm
• Formula: C17 H12 N6 O3
• Calculated formula: C17 H12 N6 O3
• SMILES: N(=O)(=O)c1ccc(NC(c2ncccc2)c2ncccc2)c2nonc12
• Title of publication: Synthesis, Characterization, and Photophysical Properties of Three Platinum(II) Complexes Bearing Fluorescent Analogues of the Di-2-pyridylmethane Ligand
• Authors of publication: Justin J. Wilson; Juliana Fedoce Lopes; Stephen J. Lippard
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 5303 - 5315
• a: 13.9662 ± 0.001 Å
• b: 10.6609 ± 0.0008 Å
• c: 21.2035 ± 0.0015 Å
• α: 90°
• β: 101.758 ± 0.001°
• γ: 90°
• Cell volume: 3090.8 ± 0.4 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0453
• Residual factor for significantly intense reflections: 0.0405
• Weighted residual factors for significantly intense reflections: 0.1047
• Weighted residual factors for all reflections included in the refinement: 0.1093
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No