Information card for entry 7058637

Structure parameters

• Formula: C21 H27 Br N2
• Calculated formula: C21 H27 Br N2
• Title of publication: Luminescent imidazolium–naphthalene salts in liquid and solid states
• Authors of publication: L’Her, Matthieu; Atoini, Youssef; Fouchet, Julien; Heinrich, Benoît; Del-Giudice, Nicolas; Scrafton, Emma; Bordes, Emilie; Karmazin, Lydia; Charbonière, Loïc; De Cola, Luisa; Douce, Laurent
• Journal of publication: New Journal of Chemistry
• Year of publication: 2019
• Journal volume: 43
• Journal issue: 32
• Pages of publication: 12529
• a: 17.7618 ± 0.0011 Å
• b: 8.5269 ± 0.0003 Å
• c: 14.2656 ± 0.0009 Å
• α: 90°
• β: 112.281 ± 0.002°
• γ: 90°
• Cell volume: 1999.25 ± 0.19 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1539
• Residual factor for significantly intense reflections: 0.0824
• Weighted residual factors for significantly intense reflections: 0.1396
• Weighted residual factors for all reflections included in the refinement: 0.1675
• Goodness-of-fit parameter for all reflections included in the refinement: 1.186
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No