Information card for entry 2236914

Structure parameters

• Chemical name: [Aquabis(nitrato-κ<i>O</i>)copper(II)]μ-{bis[5-methyl-3-(pyridin-2-yl)- 1<i>H</i>-pyrazol-4-yl]selenide}-[diaqua(nitrato-κ<i>O</i>)copper(II)] nitrate monohydrate
• Formula: C18 H24 Cu2 N10 O16 Se
• Calculated formula: C18 H24 Cu2 N10 O16 Se
• Title of publication: [Aquabis(nitrato-κ<i>O</i>)copper(II)]-μ-{bis[5-methyl-3-(pyridin-2-yl)-1<i>H</i>-pyrazol-4-yl]selenide}-[diaqua(nitrato-κ<i>O</i>)copper(II)] nitrate monohydrate
• Authors of publication: Seredyuk, Maksym; Pavlenko, Vadim A.; Gumienna-Kontecka, Elzbieta; Iskenderov, Turganbay S.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 12
• Pages of publication: m1472 - m1473
• a: 10.102 ± 0.002 Å
• b: 11.629 ± 0.002 Å
• c: 12.796 ± 0.003 Å
• α: 98.56 ± 0.03°
• β: 93.07 ± 0.03°
• γ: 93.04 ± 0.03°
• Cell volume: 1481.5 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1451
• Residual factor for significantly intense reflections: 0.08
• Weighted residual factors for significantly intense reflections: 0.1887
• Weighted residual factors for all reflections included in the refinement: 0.2228
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes