Information card for entry 7027688

Structure parameters

• Formula: C10 H26 Cu2 N14 O10
• Calculated formula: C10 H26 Cu2 N14 O10
• SMILES: c1([n](c(nc(n1)N)N)[Cu]1([O](C)[Cu]([n]2c(N)nc(N)nc2N)([OH]C)([O]1C)ON(=O)=O)([OH]C)ON(=O)=O)N
• Title of publication: Synthesis and structure of a copper(II) melamine complex, [Cu(C3H6N6)(μ-OCH3)(ONO2)(HOCH3)]2, with direct Cu‒melamine coordination
• Authors of publication: Goodgame, David M. L.; Hussain, Izhar; White, Andrew J. P.; Williams, David J.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 1999
• Journal issue: 17
• Pages of publication: 2899
• a: 7.8614 ± 0.0007 Å
• b: 7.9384 ± 0.0005 Å
• c: 10.4874 ± 0.0006 Å
• α: 89.938 ± 0.003°
• β: 81.778 ± 0.005°
• γ: 70.111 ± 0.005°
• Cell volume: 608.33 ± 0.08 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0446
• Residual factor for significantly intense reflections: 0.0357
• Weighted residual factors for all reflections: 0.1194
• Weighted residual factors for significantly intense reflections: 0.0918
• Goodness-of-fit parameter for all reflections: 1.12
• Goodness-of-fit parameter for significantly intense reflections: 1.133
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No