Information card for entry 7009216

Structure parameters

• Formula: C19.6 H48.4 Br2 Cu N18.8 O14
• Calculated formula: C19.6 H48.4 Br2 Cu N18.8 O14
• Title of publication: Modification of supramolecular motifs: perturbation of the structure of an extended hydrogen-bonded biuret array by interaction with an intercalated copper complex and methanol molecules †
• Authors of publication: Bishop, Michael M.; Lindoy, Leonard F.; Mahadev, Srihari; Turner, Peter
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 3
• Pages of publication: 233
• a: 17.1111 ± 0.0007 Å
• b: 18.1222 ± 0.0007 Å
• c: 13.4364 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4166.5 ± 0.3 ų
• Cell temperature: 297 ± 2 K
• Ambient diffraction temperature: 297 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0531
• Residual factor for significantly intense reflections: 0.0378
• Weighted residual factors for significantly intense reflections: 0.091
• Weighted residual factors for all reflections included in the refinement: 0.0986
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No