Information card for entry 2215098

Structure parameters

• Chemical name: Bis{<i>N</i>-[(1<i>Z</i>,3<i>Z</i>)-1,3-bis(4-fluorophenyl)-3- (phenylimino)prop-1-enyl]aniline(1-)}zinc(II)
• Formula: C54 H38 F4 N4 Zn
• Calculated formula: C54 H38 F4 N4 Zn
• SMILES: C1(=CC(=[N]([Zn]2(N1c1ccccc1)N(C(=CC(=[N]2c1ccccc1)c1ccc(F)cc1)c1ccc(F)cc1)c1ccccc1)c1ccccc1)c1ccc(F)cc1)c1ccc(F)cc1
• Title of publication: Bis{<i>N</i>-[(1<i>Z</i>,3<i>Z</i>)-1,3-bis(4-fluorophenyl)-3-(phenylimino)prop-1-enyl]aniline(1–)}zinc(II)
• Authors of publication: Peng, Ya-Liu; Hsueh, Mao-Lin; Lin, Chu-Chieh
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 9
• Pages of publication: m2388 - m2388
• a: 21.967 ± 0.002 Å
• b: 10.6232 ± 0.001 Å
• c: 19.2852 ± 0.0019 Å
• α: 90°
• β: 106.102 ± 0.002°
• γ: 90°
• Cell volume: 4323.8 ± 0.7 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• 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: 0.0651
• Residual factor for significantly intense reflections: 0.0404
• Weighted residual factors for significantly intense reflections: 0.0947
• Weighted residual factors for all reflections included in the refinement: 0.1054
• Goodness-of-fit parameter for all reflections included in the refinement: 0.953
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes