Information card for entry 7043181

Structure parameters

• Formula: C23 H16 N4 O
• Calculated formula: C23 H16 N4 O
• SMILES: c1(c2ccc3ccccc3c2)nc2c3cccnc3c3c(cccn3)c2[nH]1.O
• Title of publication: Synthesis, Photophysical, and Magnetic Studies of Ternary Lanthanide(III) Complexes of Naphthyl Chromophore Functionalized Imidazo[4,5-f][1,10]phenanthroline and Dibenzoylmethane.
• Authors of publication: Antony, Josephine Kanimozhi; Alexander, V.
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 14.933 ± 0.004 Å
• b: 7.4965 ± 0.0013 Å
• c: 15.999 ± 0.004 Å
• α: 90°
• β: 102.67 ± 0.007°
• γ: 90°
• Cell volume: 1747.4 ± 0.7 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/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0958
• Residual factor for significantly intense reflections: 0.0507
• Weighted residual factors for significantly intense reflections: 0.1148
• Weighted residual factors for all reflections included in the refinement: 0.1414
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No