Information card for entry 7005892

Structure parameters

• Formula: C29 H43 Cl N2 Sn
• Calculated formula: C29 H43 Cl N2 Sn
• SMILES: [Sn]1(Cl)[N](=C(N1c1c(cccc1C(C)C)C(C)C)C(C)(C)C)c1c(cccc1C(C)C)C(C)C
• Title of publication: Tert-butylamidinate tin(ii) complexes: high activity, single-site initiators for the controlled production of polylactide.
• Authors of publication: Nimitsiriwat, Nonsee; Gibson, Vernon C.; Marshall, Edward L.; White, Andrew J. P.; Dale, Sophie H.; Elsegood, Mark R. J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2007
• Journal issue: 39
• Pages of publication: 4464 - 4471
• a: 9.5201 ± 0.0004 Å
• b: 16.9282 ± 0.0006 Å
• c: 17.8114 ± 0.0007 Å
• α: 90°
• β: 90.911 ± 0.002°
• γ: 90°
• Cell volume: 2870.09 ± 0.19 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0303
• Residual factor for significantly intense reflections: 0.0237
• Weighted residual factors for significantly intense reflections: 0.0541
• Weighted residual factors for all reflections included in the refinement: 0.0583
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No