Information card for entry 2211341

Structure parameters

• Chemical name: [2-Methoxy-N'-(2-oxidobenzoyl)benzohydrazidato(3-)]dipyridinetrizinc(II)
• Formula: C40 H32 N6 O8 Zn3
• Calculated formula: C40 H32 N6 O8 Zn3
• SMILES: [Zn]12(Oc3ccccc3C3=[N]2[N](=C(O1)c1c(OC)cccc1)[Zn]1(O3)OC2c3c(O[Zn]4([N]=2[N]1=C(O4)c1c(OC)cccc1)[n]1ccccc1)cccc3)[n]1ccccc1
• Title of publication: Bis[μ-2-methoxy-<i>N</i>'-(2-oxidobenzoyl)benzohydrazidato(3‒)]dipyridinetrizinc(II)
• Authors of publication: Yu, Zong-Xue; Sun, Yu-Xi
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 12
• Pages of publication: m3521 - m3523
• a: 13.0201 ± 0.001 Å
• b: 18.4015 ± 0.0014 Å
• c: 16.6352 ± 0.0012 Å
• α: 90°
• β: 110.088 ± 0.001°
• γ: 90°
• Cell volume: 3743.2 ± 0.5 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: 0.0719
• Residual factor for significantly intense reflections: 0.0496
• Weighted residual factors for significantly intense reflections: 0.1188
• Weighted residual factors for all reflections included in the refinement: 0.1315
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes