Information card for entry 7108102

Structure parameters

• Formula: C21 H16 N2 O5 Zn
• Calculated formula: C21 H16 N2 O5 Zn
• Title of publication: Photochemical cycloaddition on the pore surface of a porous coordination polymer impacts on the sorption behavior
• Authors of publication: Hiroshi Sato; Ryotaro Matsuda; Mohammad Hedayetullah Mir; Susumu Kitagawa
• Journal of publication: Chem.Commun.
• Year of publication: 2012
• Journal volume: 48
• Pages of publication: 7919
• a: 9.7557 ± 0.0019 Å
• b: 10.106 ± 0.003 Å
• c: 12.894 ± 0.003 Å
• α: 89.221 ± 0.013°
• β: 72.476 ± 0.01°
• γ: 71.294 ± 0.009°
• Cell volume: 1143.3 ± 0.5 ų
• Cell temperature: 93 K
• Ambient diffraction temperature: 93 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 significantly intense reflections: 0.0488
• Weighted residual factors for all reflections included in the refinement: 0.1493
• Goodness-of-fit parameter for all reflections included in the refinement: 0.997
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No