Information card for entry 4343305

Structure parameters

• Formula: C17 H14 Cl2 Cu2 N P
• Calculated formula: C17 H14 Cl2 Cu2 N P
• Title of publication: Subtle Modulation of Cu4X4L2 Phosphine Cluster Cores Leads to Changes in Luminescence.
• Authors of publication: Chen, Kelly; Shearer, Jason; Catalano, Vincent J.
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 13
• Pages of publication: 6245 - 6256
• a: 12.1022 ± 0.001 Å
• b: 11.2109 ± 0.0009 Å
• c: 13.1539 ± 0.0011 Å
• α: 90°
• β: 92.01 ± 0.001°
• γ: 90°
• Cell volume: 1783.6 ± 0.3 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100.15 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0453
• Residual factor for significantly intense reflections: 0.0442
• Weighted residual factors for significantly intense reflections: 0.1144
• Weighted residual factors for all reflections included in the refinement: 0.115
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No