Information card for entry 4319890

Structure parameters

• Formula: C47 H34 Mn N3 O3 P2 S2
• Calculated formula: C47 H34 Mn N3 O3 P2 S2
• Title of publication: Syntheses, Reactivity, and π-Donating Ligand Metathesis Reaction of Five-Coordinate Sixteen-Electron Manganese(I) Complexes: Crystal Structures of [Mn(CO)3(-TeC6H4-o-NH-)]-, [(Mn(CO)3)2(μ-SC6H4-o-S-S-C6H4-o-μ-S-)], [(CO)3Mn(μ-SC6H4-o-NH2-)]2, and [(CO)3Mn(μ-SC8N2H4-o-S-)]22-
• Authors of publication: Wen-Feng Liaw; Chien-Kuo Hsieh; Ging-Yi Lin; Gene-Hsiang Lee
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 3468 - 3475
• a: 12.5774 ± 0.0003 Å
• b: 13.0335 ± 0.0002 Å
• c: 13.4917 ± 0.0003 Å
• α: 72.485 ± 0.001°
• β: 84.767 ± 0.001°
• γ: 73.453 ± 0.001°
• Cell volume: 2021.74 ± 0.07 ų
• Cell temperature: 150 ± 1 K
• Ambient diffraction temperature: 150 ± 1 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: 0.0628
• Residual factor for significantly intense reflections: 0.0413
• Weighted residual factors for all reflections: 0.098
• Weighted residual factors for significantly intense reflections: 0.0908
• Goodness-of-fit parameter for all reflections: 1.041
• Goodness-of-fit parameter for significantly intense reflections: 1.091
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No