Information card for entry 2022751

Structure parameters

• Chemical name: Bis(isoselenocyanato-κ<i>N</i>)tetrakis(pyridine-κ<i>N</i>)manganese(II)
• Formula: C22 H20 Mn N6 Se2
• Calculated formula: C22 H20 Mn N6 Se2
• Title of publication: Synthesis, crystal structure and thermal decomposition pathway of bis-(iso-seleno-cyanato-κ<i>N</i>)tetra-kis-(pyridine-κ<i>N</i>)manganese(II).
• Authors of publication: Näther, Christian; Mangelsen, Sebastian; Boeckmann, Jan
• Journal of publication: Acta crystallographica. Section E, Crystallographic communications
• Year of publication: 2023
• Journal volume: 79
• Journal issue: Pt 5
• Pages of publication: 482 - 487
• a: 12.5335 ± 0.0009 Å
• b: 13.4331 ± 0.0008 Å
• c: 15.13 ± 0.0012 Å
• α: 90°
• β: 108.608 ± 0.008°
• γ: 90°
• Cell volume: 2414.2 ± 0.3 ų
• Cell temperature: 170 ± 2 K
• Ambient diffraction temperature: 170 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0568
• Residual factor for significantly intense reflections: 0.0425
• Weighted residual factors for significantly intense reflections: 0.0831
• Weighted residual factors for all reflections included in the refinement: 0.0881
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes