Information card for entry 4333971

Structure parameters

• Formula: C29 H16 Co N2 O6.5
• Calculated formula: C29 H16 Co N2 O6.5
• Title of publication: A Porous 4-Fold-Interpenetrated Chiral Framework Exhibiting Vapochromism, Single-Crystal-to-Single-Crystal Solvent Exchange, Gas Sorption, and a Poisoning Effect
• Authors of publication: Ming-Hua Zeng; Yan-Xi Tan; Yan-Ping He; Zheng Yin; Qing Chen; Mohamedally Kurmoo
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 2353 - 2360
• a: 22.6904 ± 0.0017 Å
• b: 22.6904 ± 0.0017 Å
• c: 12.695 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6536.1 ± 1.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 90
• Hermann-Mauguin space group symbol: P 4 21 2
• Hall space group symbol: P 4ab 2ab
• Residual factor for all reflections: 0.1118
• Residual factor for significantly intense reflections: 0.0779
• Weighted residual factors for significantly intense reflections: 0.206
• Weighted residual factors for all reflections included in the refinement: 0.226
• Goodness-of-fit parameter for all reflections included in the refinement: 1.073
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No