Information card for entry 7046695

Structure parameters

• Formula: C12 H10 O4 Se2 Zn
• Calculated formula: C12 H10 O4 Se2 Zn
• Title of publication: Synthesis of first row transition metal selenomaltol complexes.
• Authors of publication: Spiegel, Michael T.; Hoogerbrugge, Amanda; Truksa, Shamus; Smith, Andrew G.; Shuford, Kevin L.; Klausmeyer, Kevin K.; Farmer, Patrick J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 27
• Pages of publication: 9030 - 9037
• a: 7.6565 ± 0.0003 Å
• b: 23.8778 ± 0.0011 Å
• c: 7.4531 ± 0.0003 Å
• α: 90°
• β: 91.8542 ± 0.0016°
• γ: 90°
• Cell volume: 1361.87 ± 0.1 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: 0.0282
• Residual factor for significantly intense reflections: 0.0222
• Weighted residual factors for significantly intense reflections: 0.0477
• Weighted residual factors for all reflections included in the refinement: 0.0502
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No