Information card for entry 1569048

Structure parameters

• Formula: C2 Cu O4
• Calculated formula: C2 Cu O4
• Title of publication: Crystal Chemistry of the Copper Oxalate Biomineral Moolooite: The First Single-Crystal X-ray Diffraction Studies and Thermal Behavior.
• Authors of publication: Kornyakov, Ilya V.; Gurzhiy, Vladislav V.; Kuz'mina, Mariya A.; Krzhizhanovskaya, Maria G.; Chukanov, Nikita V.; Chislov, Mikhail V.; Korneev, Anatolii V.; Izatulina, Alina R.
• Journal of publication: International journal of molecular sciences
• Year of publication: 2023
• Journal volume: 24
• Journal issue: 7
• Pages of publication: 6786
• a: 6.147 ± 0.003 Å
• b: 5.433 ± 0.002 Å
• c: 5.1173 ± 0.0018 Å
• α: 90°
• β: 114.51 ± 0.05°
• γ: 90°
• Cell volume: 155.5 ± 0.13 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1334
• Residual factor for significantly intense reflections: 0.0958
• Weighted residual factors for significantly intense reflections: 0.2519
• Weighted residual factors for all reflections included in the refinement: 0.2706
• Goodness-of-fit parameter for all reflections included in the refinement: 1.27
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No