Information card for entry 2017168

Structure parameters

• Common name: Dicopper(II) trihydroxide cyanoureate dihydrate
• Chemical name: Poly[[μ-cyanoureato-tri-μ-hydroxido-dicopper(II)] dihydrate]
• Formula: C2 H9 Cu2 N3 O6
• Calculated formula: C2 H9 Cu2 N3 O6
• Title of publication: Dicopper(II) trihydroxide cyanoureate dihydrate
• Authors of publication: Chippindale, Ann M.; Hibble, Simon J.; Bilbé, Edward J.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 7
• Pages of publication: i39 - i41
• a: 12.4648 ± 0.0005 Å
• b: 6.3096 ± 0.0002 Å
• c: 10.6032 ± 0.0005 Å
• α: 90°
• β: 103.269 ± 0.004°
• γ: 90°
• Cell volume: 811.66 ± 0.06 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 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 all reflections: 0.0634
• Residual factor for significantly intense reflections: 0.0308
• Weighted residual factors for all reflections: 0.0267
• Weighted residual factors for significantly intense reflections: 0.0249
• Weighted residual factors for all reflections included in the refinement: 0.0249
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1139
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes