Information card for entry 7021427

Structure parameters

• Formula: C112 H86 N12 O6 Zn2
• Calculated formula: C112 H86 N12 O6 Zn2
• Title of publication: Chiral recognition of amino acid esters by a novel oxalic amide-linked bisporphyrin.
• Authors of publication: Jiang, Jiaxun; Feng, Zhiqiang; Liu, Baozhen; Hu, Chuanjiang; Wang, Yong
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 21
• Pages of publication: 7651 - 7659
• a: 13.264 ± 0.003 Å
• b: 14.531 ± 0.003 Å
• c: 15.136 ± 0.003 Å
• α: 75.06 ± 0.03°
• β: 74 ± 0.03°
• γ: 85.09 ± 0.03°
• Cell volume: 2709.2 ± 1.1 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 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: 0.0919
• Residual factor for significantly intense reflections: 0.0766
• Weighted residual factors for significantly intense reflections: 0.2293
• Weighted residual factors for all reflections included in the refinement: 0.2455
• Goodness-of-fit parameter for all reflections included in the refinement: 1.105
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No