Information card for entry 4077998

Structure parameters

• Formula: C36 H26 Br2 Sn
• Calculated formula: C36 H26 Br2 Sn
• SMILES: [Sn](c1ccc2c3c(ccc(Br)c13)CC2)(c1ccc2c3c(ccc(Br)c13)CC2)(c1ccccc1)c1ccccc1
• Title of publication: Sterically Crowded Tin Acenaphthenes
• Authors of publication: Lechner, Marie-Luise; Athukorala Arachchige, Kasun S.; Randall, Rebecca A. M.; Knight, Fergus R.; Bühl, Michael; Slawin, Alexandra M. Z.; Woollins, J. Derek
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 7
• Pages of publication: 2922
• a: 10.073 ± 0.005 Å
• b: 11.839 ± 0.004 Å
• c: 12.381 ± 0.006 Å
• α: 90.697 ± 0.01°
• β: 109.926 ± 0.012°
• γ: 95.247 ± 0.009°
• Cell volume: 1380.8 ± 1.1 ų
• Cell temperature: 93 K
• Ambient diffraction temperature: 93 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 significantly intense reflections: 0.0512
• Weighted residual factors for all reflections included in the refinement: 0.1396
• Goodness-of-fit parameter for all reflections included in the refinement: 1.087
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No