Information card for entry 1515827

Structure parameters

• Chemical name: coordination pillared layer strcuture
• Formula: C12 H6 Cu N5 O4
• Calculated formula: C12 H6 Cu N5 O4
• Title of publication: Temperature responsive channel uniformity impacts on highly guest-selective adsorption in a porous coordination polymer
• Authors of publication: Matsuda, Ryotaro; Tsujino, Takashi; Sato, Hiroshi; Kubota, Yoshiki; Morishige, Kunimitsu; Takata, Masaki; Kitagawa, Susumu
• Journal of publication: Chemical Science
• Year of publication: 2010
• Journal volume: 1
• Journal issue: 3
• Pages of publication: 315
• a: 4.651 ± 0.002 Å
• b: 34.683 ± 0.004 Å
• c: 10.812 ± 0.001 Å
• α: 90°
• β: 95.8 ± 0.02°
• γ: 90°
• Cell volume: 1735.2 ± 0.8 ų
• Cell temperature: 300 K
• Ambient diffraction temperature: 300 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 R(I) for significantly intense reflections: 0.0362
• Goodness-of-fit parameter for all reflections: 1.3685
• Method of determination: powder diffraction
• Diffraction radiation wavelength: 0.80101 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No