Information card for entry 2223121

Structure parameters

• Chemical name: Bis{2-[(1<i>H</i>-pyrrol-2-yl)methyliminomethyl]phenolato- κ^2^<i>N</i>,<i>O</i>}zinc(II)
• Formula: C24 H22 N4 O2 Zn
• Calculated formula: C24 H22 N4 O2 Zn
• SMILES: c12c(cccc1)C=[N](Cc1[nH]ccc1)[Zn]1(O2)[N](=Cc2c(cccc2)O1)Cc1[nH]ccc1
• Title of publication: Bis{2-[(1<i>H</i>-pyrrol-2-yl)methyliminomethyl]phenolato-κ^2^<i>N</i>,<i>O</i>}zinc(II)
• Authors of publication: Cui, Yong-Ming; Zhang, Xian; Liu, Lian; Wang, Qiang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 9
• Pages of publication: m1151
• a: 5.3443 ± 0.0004 Å
• b: 9.8669 ± 0.0008 Å
• c: 10.1392 ± 0.0008 Å
• α: 104.108 ± 0.001°
• β: 95.83 ± 0.001°
• γ: 100.126 ± 0.001°
• Cell volume: 504.58 ± 0.07 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 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: 0.0503
• Residual factor for significantly intense reflections: 0.05
• Weighted residual factors for significantly intense reflections: 0.1431
• Weighted residual factors for all reflections included in the refinement: 0.1435
• Goodness-of-fit parameter for all reflections included in the refinement: 1.114
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes