Information card for entry 7103357

Structure parameters

• Formula: C16 H15 Cu N O5
• Calculated formula: C16 H13 Cu N O5
• Title of publication: Kagomé type extra-large microporous solid based on a paddle-wheel Cu2+ dimer.
• Authors of publication: Horike, Satoshi; Hasegawa, Shinpei; Tanaka, Daisuke; Higuchi, Masakazu; Kitagawa, Susumu
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2008
• Journal issue: 37
• Pages of publication: 4436 - 4438
• a: 41.28 ± 0.02 Å
• b: 41.28 ± 0.02 Å
• c: 9.864 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 14556.3 ± 11.5 ų
• Cell temperature: 223.1 K
• Number of distinct elements: 5
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for significantly intense reflections: 0.083
• Weighted residual factors for all reflections included in the refinement: 0.148
• Goodness-of-fit parameter for all reflections included in the refinement: 0.903
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No