Information card for entry 4322855

Structure parameters

• Formula: C16 H32 Cl5 Mn2.5 O4
• Calculated formula: C15 H32 Cl5 Mn2.5 O4
• Title of publication: Polynuclear Aggregation of Manganese Dichloride. Syntheses, Properties, and Structures of Polymeric [MnCl2(THF)1.6]\ιnfty, Dimeric [(THF)4Mg(μ-Cl)2MnCl2], and Ionic [Mg(H2O)2(THF)4][Mg(H2O)4(THF)2][MnCl4]2.2THF Compounds
• Authors of publication: Piotr Sobota; Józef Utko; Lucjan B. Jerzykiewicz
• Journal of publication: Inorganic Chemistry
• Year of publication: 1998
• Journal volume: 37
• Pages of publication: 3428 - 3431
• a: 9.547 ± 0.002 Å
• b: 11.191 ± 0.002 Å
• c: 12.667 ± 0.003 Å
• α: 74.19 ± 0.03°
• β: 76.16 ± 0.03°
• γ: 77.62 ± 0.03°
• Cell volume: 1248.1 ± 0.5 ų
• Cell temperature: 299 ± 2 K
• Ambient diffraction temperature: 299 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0722
• Residual factor for significantly intense reflections: 0.0342
• Weighted residual factors for all reflections: 0.112
• Weighted residual factors for significantly intense reflections: 0.0953
• Goodness-of-fit parameter for all reflections: 1.07
• Goodness-of-fit parameter for significantly intense reflections: 1.141
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No