Information card for entry 7719934

Structure parameters

• Formula: C18 H20 Cl5 Mo N2 O2
• Calculated formula: C18 H20 Cl5 Mo N2 O2
• Title of publication: Near-Infrared Luminescence of a Novel Zero-Dimensional Organic-Inorganic Hybrid Molybdenum-Based Perovskite
• Authors of publication: Wang, Chao; Wang, Junlin; Cai, Xiangfeng; Wang, Zhihui
• Journal of publication: Dalton Transactions
• Year of publication: 2025
• a: 10.65 ± 0.0003 Å
• b: 13.4534 ± 0.0003 Å
• c: 16.6691 ± 0.0004 Å
• α: 87.9601 ± 0.0019°
• β: 89.0965 ± 0.0018°
• γ: 67.789 ± 0.002°
• Cell volume: 2209.7 ± 0.1 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 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: 0.0616
• Residual factor for significantly intense reflections: 0.0574
• Weighted residual factors for significantly intense reflections: 0.1684
• Weighted residual factors for all reflections included in the refinement: 0.1725
• Goodness-of-fit parameter for all reflections included in the refinement: 0.893
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No