Information card for entry 4332540

Structure parameters

• Chemical name: [MnCl2(L3)2]-1/2(EtOH)-1/2(H2O)
• Formula: C49 H46 Cl2 Mn N6 O7
• Calculated formula: C49 H44.5 Cl2 Mn N6 O7
• Title of publication: Syntheses, Structures, and Photoluminescence Properties of Metal(II) Halide Complexes with Pyridine-Containing Flexible Tripodal Ligands
• Authors of publication: Wu, Gang; Wang, Xiao-Feng; Okamura, Taka-aki; Sun, Wei-Yin; Ueyama, Norikazu
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 21
• Pages of publication: 8523 - 8532
• a: 35.122 ± 0.013 Å
• b: 7.767 ± 0.003 Å
• c: 16.511 ± 0.007 Å
• α: 90°
• β: 98.55 ± 0.03°
• γ: 90°
• Cell volume: 4454 ± 3 ų
• Cell temperature: 200 K
• Ambient diffraction temperature: 200 K
• Number of distinct elements: 6
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.1482
• Residual factor for significantly intense reflections: 0.0431
• Weighted residual factors for significantly intense reflections: 0.043
• Weighted residual factors for all reflections included in the refinement: 0.0476
• Goodness-of-fit parameter for all reflections included in the refinement: 0.719
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No