Information card for entry 7229395

Structure parameters

• Chemical name: Al-3-methoxysalophen
• Formula: C23 H26 Al N3 O10
• Calculated formula: C23 H26 Al N3 O10
• SMILES: [Al]123(Oc4c(C=[N]3c3c([N]2=Cc2cccc(OC)c2O1)cccc3)cccc4OC)([OH2])[OH2].OC.O=N(=O)[O-]
• Title of publication: Enhanced fluorescence with nanosecond dynamics in solid state of metal Ion complexes of alkoxy salophens
• Authors of publication: Khan, Tuhin; Datta, Anindya
• Journal of publication: Phys. Chem. Chem. Phys.
• Year of publication: 2017
• a: 12.1864 ± 0.0003 Å
• b: 13.4221 ± 0.0003 Å
• c: 16.0962 ± 0.0003 Å
• α: 88.6544 ± 0.0017°
• β: 80.3988 ± 0.0018°
• γ: 66.631 ± 0.002°
• Cell volume: 2380.33 ± 0.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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: 0.047
• Residual factor for significantly intense reflections: 0.0428
• Weighted residual factors for significantly intense reflections: 0.1117
• Weighted residual factors for all reflections included in the refinement: 0.115
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No