Information card for entry 7001921

Structure parameters

• Formula: C15 H12 N2 O2
• Calculated formula: C15 H12 N2 O2
• SMILES: O=C1N(C(=O)c2c1cccc2)CCc1ncccc1
• Title of publication: The coordination chemistry of fluorescent pyridinyl‒ and quinolinyl‒phthalimide ligands with the {AuI‒PPh3} cationic unit
• Authors of publication: Mullice, Lucy A.; Thorp-Greenwood, Flora L.; Laye, Rebecca H.; Coogan, Michael P.; Kariuki, Benson M.; Pope, Simon J.A.
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 34
• Pages of publication: 6836 - 6842
• a: 5.3683 ± 0.0009 Å
• b: 10.1138 ± 0.0016 Å
• c: 12.1952 ± 0.0019 Å
• α: 69.049 ± 0.011°
• β: 87.126 ± 0.01°
• γ: 82.37 ± 0.009°
• Cell volume: 612.87 ± 0.18 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0638
• Residual factor for significantly intense reflections: 0.0393
• Weighted residual factors for significantly intense reflections: 0.0871
• Weighted residual factors for all reflections included in the refinement: 0.0991
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No