Information card for entry 7040839

Structure parameters

• Formula: C8 H11 Cu I N3
• Calculated formula: C8 H11 Cu I N3
• Title of publication: White luminescence achieved by a multiple thermochromic emission in a hybrid organic-inorganic compound based on 3-picolylamine and copper(i) iodide.
• Authors of publication: Farinella, F.; Maini, L.; Mazzeo, P. P.; Fattori, V.; Monti, F.; Braga, D.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 44
• Pages of publication: 17939 - 17947
• a: 9.3471 ± 0.001 Å
• b: 14.4575 ± 0.0016 Å
• c: 8.0186 ± 0.0009 Å
• α: 90°
• β: 90.4695 ± 0.0007°
• γ: 90°
• Cell volume: 1083.6 ± 0.2 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor R(I) for significantly intense reflections: 0.0247
• Goodness-of-fit parameter for all reflections: 11.6137
• Method of determination: powder diffraction
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.775311 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No