Information card for entry 4348558

Structure parameters

• Common name: matlf04
• Formula: C12 H36 Cl1.74 Fe1.74 O17.26 V4.26
• Calculated formula: C12 H36 Cl1.74 Fe1.74 O17.26 V4.26
• Title of publication: Self-Assembled, Iron-Functionalized Polyoxovanadate Alkoxide Clusters.
• Authors of publication: Li, Feng; VanGelder, Lauren E.; Brennessel, William W.; Matson, Ellen M.
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 15
• Pages of publication: 7332 - 7334
• a: 9.6791 ± 0.0004 Å
• b: 9.7647 ± 0.0004 Å
• c: 15.2953 ± 0.0006 Å
• α: 90°
• β: 90.132 ± 0.0009°
• γ: 90°
• Cell volume: 1445.61 ± 0.1 ų
• Cell temperature: 100 ± 0.5 K
• Ambient diffraction temperature: 100 ± 0.5 K
• Number of distinct elements: 6
• 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: 0.075
• Residual factor for significantly intense reflections: 0.0467
• Weighted residual factors for significantly intense reflections: 0.1231
• Weighted residual factors for all reflections included in the refinement: 0.1396
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No