Information card for entry 7024532

Structure parameters

• Formula: C52 H72 Cu8 I8 N16
• Calculated formula: C52 H72 Cu8 I8 N16
• Title of publication: Functionalized 1,2,3-triazoles as building blocks for photoluminescent POLOs (polymers of oligomers) of copper(I).
• Authors of publication: Bai, Shi-Qiang; Kwang, Jia Yi; Koh, Lip Lin; Young, David J.; Hor, T. S. Andy
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 10
• Pages of publication: 2631 - 2636
• a: 14.4297 ± 0.0019 Å
• b: 16.937 ± 0.002 Å
• c: 17.684 ± 0.002 Å
• α: 76.127 ± 0.002°
• β: 66.663 ± 0.002°
• γ: 65.04 ± 0.002°
• Cell volume: 3584 ± 0.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0681
• Residual factor for significantly intense reflections: 0.0581
• Weighted residual factors for significantly intense reflections: 0.1564
• Weighted residual factors for all reflections included in the refinement: 0.1606
• Goodness-of-fit parameter for all reflections included in the refinement: 1.107
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No