Information card for entry 2006128

Structure parameters

• Chemical name: Tricyclohexyl-N-phthaloylglycinatotin
• Formula: C28 H39 N O4 Sn
• Calculated formula: C28 H39 N O4 Sn
• SMILES: C1(CCCCC1)[Sn](C1CCCCC1)(OC(=O)CN1C(=O)c2c(C1=O)cccc2)C1CCCCC1
• Title of publication: Tricyclohexyl(<i>N</i>-phthaloylglycinato)tin(IV)
• Authors of publication: Ng, Seik Weng; Kumar Das, V. G.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1997
• Journal volume: 53
• Journal issue: 5
• Pages of publication: 546 - 548
• a: 11.003 ± 0.001 Å
• b: 13.3701 ± 0.0009 Å
• c: 18.408 ± 0.002 Å
• α: 90°
• β: 96.734 ± 0.005°
• γ: 90°
• Cell volume: 2689.3 ± 0.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 2980 ± 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: 0.0706
• Residual factor for significantly intense reflections: 0.0446
• Weighted residual factors for all reflections: 0.0942
• Weighted residual factors for significantly intense reflections: 0.0862
• Goodness-of-fit parameter for all reflections: 0.98
• Goodness-of-fit parameter for significantly intense reflections: 1.081
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No