Information card for entry 8105699

Structure parameters

• Formula: C86 H60 Fe5 N2 O14 P4 Te4
• Calculated formula: C86 H60 Fe5 N2 O14 P4 Te4
• Title of publication: Crystal structure of bis(bis(triphenylphosphine)iminium) tetradecacarbonyltetratelluridopentaferrate(2-), (PPN)2[Fe5Te4(CO)14]
• Authors of publication: Kim, Kang-Woo; Yang, Hyoyi
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2022
• Journal volume: 237
• Journal issue: 3
• Pages of publication: 369 - 372
• a: 13.6807 ± 0.0007 Å
• b: 18.5116 ± 0.0011 Å
• c: 19.321 ± 0.001 Å
• α: 78.17 ± 0.002°
• β: 70.1007 ± 0.0018°
• γ: 70.5341 ± 0.0019°
• Cell volume: 4314.7 ± 0.4 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0659
• Residual factor for significantly intense reflections: 0.0411
• Weighted residual factors for significantly intense reflections: 0.0992
• Weighted residual factors for all reflections included in the refinement: 0.1234
• Goodness-of-fit parameter for all reflections included in the refinement: 1.091
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No