Information card for entry 4347711

Structure parameters

• Formula: C24 H56 Co N2 P4 S4
• Calculated formula: C24 H40 Co N2 P4 S4
• Title of publication: Magnetic Anisotropy of Tetrahedral Co^II Single-Ion Magnets: Solid-State Effects.
• Authors of publication: Sottini, Silvia; Poneti, Giordano; Ciattini, Samuele; Levesanos, Nikolaos; Ferentinos, Eleftherios; Krzystek, J.; Sorace, Lorenzo; Kyritsis, Panayotis
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 19
• Pages of publication: 9537 - 9548
• a: 15.5878 ± 0.0003 Å
• b: 15.5878 ± 0.0003 Å
• c: 14.0473 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3413.21 ± 0.15 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 88
• Hermann-Mauguin space group symbol: I 41/a :2
• Hall space group symbol: -I 4ad
• Residual factor for all reflections: 0.0673
• Residual factor for significantly intense reflections: 0.054
• Weighted residual factors for all reflections included in the refinement: 0.1507
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No