Information card for entry 1568617

Structure parameters

• Formula: C4 H24 Cl7 Mo N4
• Calculated formula: C4 H24 Cl7 Mo N4
• Title of publication: Molybdenum chloride double perovskites: dimensionality control of optical and magnetic properties.
• Authors of publication: Binwal, Devesh Chandra; Mudoi, Prashurya Pritam; Panda, Debendra Prasad; Vishnoi, Pratap
• Journal of publication: Chemical science
• Year of publication: 2023
• Journal volume: 14
• Journal issue: 15
• Pages of publication: 3982 - 3989
• a: 16.0647 ± 0.0009 Å
• b: 7.3477 ± 0.0004 Å
• c: 16.1264 ± 0.0008 Å
• α: 90°
• β: 103.599 ± 0.002°
• γ: 90°
• Cell volume: 1850.17 ± 0.17 ų
• Cell temperature: 300 ± 2 K
• Ambient diffraction temperature: 300 ± 2 K
• Number of distinct elements: 5
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/n 1
• Hall space group symbol: -P 2yac
• Residual factor for all reflections: 0.041
• Residual factor for significantly intense reflections: 0.0251
• Weighted residual factors for significantly intense reflections: 0.0496
• Weighted residual factors for all reflections included in the refinement: 0.054
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No