Information card for entry 7012781

Structure parameters

• Formula: C27 H21 Cu2 N25 O12
• Calculated formula: C27 H21 Cu2 N25 O12
• Title of publication: Synthesis, structure and heterogeneous catalytic activity of a coordination polymer containing tetranuclear Cu(ii)-btp units connected by nitrates
• Authors of publication: Yoo, Sang-Kun; Ryu, Ji Young; Lee, Jun Yong; Kim, Cheal; Kim, Sung-Jin; Kim, Youngmee
• Journal of publication: Dalton Transactions
• Year of publication: 2003
• Journal issue: 8
• Pages of publication: 1454
• a: 11.1473 ± 0.0003 Å
• b: 13.3356 ± 0.0003 Å
• c: 13.4689 ± 0.0003 Å
• α: 78.475 ± 0.002°
• β: 70.419 ± 0.002°
• γ: 76.033 ± 0.002°
• Cell volume: 1815.12 ± 0.08 ų
• Cell temperature: 150 ± 1 K
• Ambient diffraction temperature: 150 ± 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: 0.1003
• Residual factor for significantly intense reflections: 0.0751
• Weighted residual factors for significantly intense reflections: 0.1947
• Weighted residual factors for all reflections included in the refinement: 0.2211
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No