Information card for entry 7034033

Structure parameters

• Formula: C12 H10 Cu2 I2 N4
• Calculated formula: C12 H10 Cu2 I2 N4
• Title of publication: Luminescent [Cu4I4] aggregates and [Cu3I3]-cyclic coordination polymers supported by quinolyl-triazoles.
• Authors of publication: Bai, Shi-Qiang; Jiang, Lu; Young, David James; Hor, T. S. Andy
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 13
• Pages of publication: 6075 - 6081
• a: 8.2321 ± 0.0004 Å
• b: 8.4671 ± 0.0004 Å
• c: 11.9898 ± 0.0005 Å
• α: 94.026 ± 0.001°
• β: 95.045 ± 0.001°
• γ: 115.853 ± 0.001°
• Cell volume: 743.64 ± 0.06 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: 0.0194
• Residual factor for significantly intense reflections: 0.0188
• Weighted residual factors for significantly intense reflections: 0.044
• Weighted residual factors for all reflections included in the refinement: 0.0443
• Goodness-of-fit parameter for all reflections included in the refinement: 1.195
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No