Information card for entry 4319957

Structure parameters

• Formula: C36 H30 As2 I2 Mn O2
• Calculated formula: C36 H30 As2 I2 Mn O2
• SMILES: [Mn](I)(I)([O]=[As](c1ccccc1)(c1ccccc1)c1ccccc1)[O]=[As](c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Correlation of Structure and Triboluminescence for Tetrahedral Manganese(II) Compounds
• Authors of publication: F. Albert Cotton; Lee M. Daniels; Penglin Huang
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 3576 - 3578
• a: 10.094 ± 0.004 Å
• b: 10.439 ± 0.002 Å
• c: 34.852 ± 0.015 Å
• α: 83.17 ± 0.04°
• β: 86.09 ± 0.02°
• γ: 75.16 ± 0.03°
• Cell volume: 3522 ± 2 ų
• Cell temperature: 213 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0599
• Residual factor for significantly intense reflections: 0.0485
• Weighted residual factors for all reflections: 0.118
• Weighted residual factors for significantly intense reflections: 0.1081
• Goodness-of-fit parameter for all reflections: 1.1
• Goodness-of-fit parameter for significantly intense reflections: 1.093
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No