Information card for entry 2003514

Structure parameters

• Formula: C15 H22 Cu N8 O8
• Calculated formula: C15 H22 Cu N8 O8
• Title of publication: Aqua[1,3-propanediyldiiminobis(1,3-dimethyl-5-nitrosouracilato)-κ^4^<i>N</i>^5^,<i>N</i>^6^,<i>N</i>^15^,<i>N</i>^16^]copper(II) Monohydrate
• Authors of publication: Kivekäs, R.; Klinga, M.; Colacio, E.; Dominguez-Vera, J. M.; Romerosa, A.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 6
• Pages of publication: 1087 - 1089
• a: 10.809 ± 0.001 Å
• b: 8.4044 ± 0.0009 Å
• c: 21.119 ± 0.003 Å
• α: 90°
• β: 96.63 ± 0.01°
• γ: 90°
• Cell volume: 1905.7 ± 0.4 ų
• Cell temperature: 296 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 for significantly intense reflections: 0.04
• Weighted residual factors for significantly intense reflections: 0.036
• Goodness-of-fit parameter for significantly intense reflections: 2.064
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No