Information card for entry 4311223

Structure parameters

• Chemical name: Triphenylsulfonium manganese(II) tris(dicyanamide)
• Formula: C24 H15 Mn N9 S
• Calculated formula: C24 H15 Mn N9 S
• Title of publication: Spin Canting in the 3D Anionic Dicyanamide Structure (SPh~3~)Mn(dca)~3~ (Ph = phenyl, dca = dicyanamide)
• Authors of publication: John A. Schlueter; Jamie L. Manson; Kylee A. Hyzer; Urs Geiser
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 4100 - 4102
• a: 11.7079 ± 0.0005 Å
• b: 12.8554 ± 0.0005 Å
• c: 16.8605 ± 0.0006 Å
• α: 90°
• β: 100.666 ± 0.002°
• γ: 90°
• Cell volume: 2493.83 ± 0.17 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.0503
• Residual factor for significantly intense reflections: 0.035
• Weighted residual factors for significantly intense reflections: 0.0986
• Weighted residual factors for all reflections included in the refinement: 0.1079
• Goodness-of-fit parameter for all reflections included in the refinement: 1.064
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No