Information card for entry 4002860

Structure parameters

• Formula: C15 H15 Cu I N6 O P
• Calculated formula: C15 H15 Cu I N6 O P
• Title of publication: Cation-Induced Strategy toward an Hourglass-Shaped Cu6I7‒ Cluster and Its Color-Tunable Luminescence
• Authors of publication: Yu, Muxin; Chen, Lian; Jiang, Feilong; Zhou, Kang; Liu, Caiping; Sun, Cai; Li, Xingjun; Yang, Yan; Hong, Maochun
• Journal of publication: Chemistry of Materials
• Year of publication: 2017
• Journal volume: 29
• Journal issue: 19
• Pages of publication: 8093
• a: 9.0437 ± 0.0006 Å
• b: 10.8072 ± 0.0006 Å
• c: 10.8381 ± 0.0007 Å
• α: 116.35 ± 0.006°
• β: 102.549 ± 0.006°
• γ: 96.607 ± 0.005°
• Cell volume: 899.05 ± 0.12 ų
• Cell temperature: 100 ± 0.11 K
• Ambient diffraction temperature: 100 ± 0.11 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0345
• Residual factor for significantly intense reflections: 0.0315
• Weighted residual factors for significantly intense reflections: 0.0793
• Weighted residual factors for all reflections included in the refinement: 0.0819
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No