Information card for entry 7001255

Structure parameters

• Formula: C23 H29 Br3 N2 O Sn
• Calculated formula: C23 H29 Br3 N2 O Sn
• SMILES: [Sn]12N(c4c(cc(cc4Br)Br)Br)C([N]1(C)C)c1cc(cc(c1O2)C(C)(C)C)C(C)(C)C
• Title of publication: Bidentate salicylaldiminato tin(ii) complexes and their use as lactide polymerisation initiators
• Authors of publication: Nimitsiriwat, Nonsee; Gibson, Vernon C.; Marshall, Edward L.; Elsegood, Mark R. J.
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 19
• Pages of publication: 3710 - 3715
• a: 9.0297 ± 0.0002 Å
• b: 10.2931 ± 0.0003 Å
• c: 14.054 ± 0.0004 Å
• α: 78.4205 ± 0.0012°
• β: 88.3895 ± 0.0017°
• γ: 80.8048 ± 0.0018°
• Cell volume: 1263.19 ± 0.06 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 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: 0.039
• Residual factor for significantly intense reflections: 0.0301
• Weighted residual factors for significantly intense reflections: 0.07
• Weighted residual factors for all reflections included in the refinement: 0.0734
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No