Information card for entry 7013894

Structure parameters

• Formula: C40 H50 N4 O2 Zn
• Calculated formula: C40 H50 N4 O2 Zn
• SMILES: [Zn]123(Oc4c(cc(cc4C=[N]2c2c([N]3=Cc3c(O1)c(cc(c3)C(C)(C)C)C(C)(C)C)nccc2)C(C)(C)C)C(C)(C)C)[n]1ccccc1
• Title of publication: Synthesis of photo-luminescent Zn(II) Schiff base complexes and its derivative containing Pd(II) moiety.
• Authors of publication: Chang, Ku-Hsien; Huang, Chiung-Cheng; Liu, Yi-Hung; Hu, Ya-Hui; Chou, Pi-Tai; Lin, Ying-Chih
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2004
• Journal issue: 11
• Pages of publication: 1731 - 1738
• a: 12.963 ± 0.0002 Å
• b: 15.488 ± 0.0003 Å
• c: 18.846 ± 0.0003 Å
• α: 90°
• β: 92.831 ± 0.001°
• γ: 90°
• Cell volume: 3779.11 ± 0.11 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 5
• 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: 0.0888
• Residual factor for significantly intense reflections: 0.0477
• Weighted residual factors for all reflections: 0.1417
• Weighted residual factors for significantly intense reflections: 0.1143
• Goodness-of-fit parameter for all reflections: 1.054
• Goodness-of-fit parameter for significantly intense reflections: 1.086
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No