Information card for entry 1573187

Structure parameters

• Formula: C12 H8 Al4 Br8
• Calculated formula: C12 H8 Al4 Br8
• SMILES: [c]123c(cccc1)[Al](Br)([Br][Al]2(Br)Br)[c]12c(cccc1)[Al]3(Br)[Br][Al]2(Br)Br
• Title of publication: Donor-free 9,10-dihydro-9,10-dialuminaanthracenes.
• Authors of publication: Lückert, Paula L; Gilmer, Jannik; Virovets, Alexander; Lerner, Hans-Wolfram; Wagner, Matthias
• Journal of publication: Chemical science
• Year of publication: 2024
• Journal volume: 16
• Journal issue: 1
• Pages of publication: 147 - 155
• a: 8.071 ± 0.0005 Å
• b: 8.2992 ± 0.0006 Å
• c: 9.8658 ± 0.0007 Å
• α: 108.901 ± 0.007°
• β: 101.51 ± 0.006°
• γ: 103.983 ± 0.006°
• Cell volume: 578.24 ± 0.08 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0376
• Residual factor for significantly intense reflections: 0.0332
• Weighted residual factors for significantly intense reflections: 0.0827
• Weighted residual factors for all reflections included in the refinement: 0.0867
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No