Information card for entry 1529230

Structure parameters

• Chemical name: [tetrakis(mu~2~-thiobarbiturato-O,O')-bis(thiobarbiturato-O)-hexaaqua-dieuropium]
• Formula: C12 H15 Eu N6 O9 S3
• Calculated formula: C12 H15 Eu N6 O9 S3
• Title of publication: Crystal structure of polymer hexaaqua-hexakis(2-thiobarbiturato) dieuropium(III)
• Authors of publication: Golovnev, Nicolay; Molokeev, Maxim
• Journal of publication: Russian Journal of Coordination Chemistry
• Year of publication: 2014
• Journal volume: 40
• Journal issue: 9
• Pages of publication: 648
• a: 14.1033 ± 0.0004 Å
• b: 10.0988 ± 0.0004 Å
• c: 15.4061 ± 0.0005 Å
• α: 90°
• β: 110.003 ± 0.001°
• γ: 90°
• Cell volume: 2061.87 ± 0.12 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/n 1
• Hall space group symbol: -P 2yac
• Residual factor for all reflections: 0.0609
• Residual factor for significantly intense reflections: 0.0373
• Weighted residual factors for significantly intense reflections: 0.0775
• Weighted residual factors for all reflections included in the refinement: 0.088
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes