Information card for entry 7231234

Structure parameters

• Formula: C36 H26 Cl4 Hg N4 O4
• Calculated formula: C36 H26 Cl4 Hg N4 O4
• Title of publication: Tetrahalometallate salts of N-(4-picolinium)-1,8-naphthalimide: structures and solid-state fluorescence
• Authors of publication: Beebeejaun-Boodoo, B. M. P.; Erasmus, R.; Rademeyer, M.
• Journal of publication: CrystEngComm
• Year of publication: 2018
• Journal volume: 20
• Journal issue: 33
• Pages of publication: 4875
• a: 7.8598 ± 0.0004 Å
• b: 14.7496 ± 0.0009 Å
• c: 14.7874 ± 0.0008 Å
• α: 102.704 ± 0.002°
• β: 101.054 ± 0.002°
• γ: 93.104 ± 0.002°
• Cell volume: 1632.97 ± 0.16 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0553
• Residual factor for significantly intense reflections: 0.0485
• Weighted residual factors for significantly intense reflections: 0.101
• Weighted residual factors for all reflections included in the refinement: 0.1047
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No