Information card for entry 7032812

Structure parameters

• Formula: C136 H152 F15 N5 O19 Zn6
• Calculated formula: C136 H152 F15 N5 O19 Zn6
• Title of publication: Zinc calixarene complexes for the ring opening polymerization of cyclic esters.
• Authors of publication: Walton, Mark J.; Lancaster, Simon J.; Wright, Joseph A.; Elsegood, Mark R. J.; Redshaw, Carl
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 48
• Pages of publication: 18001 - 18009
• a: 16.9733 ± 0.0014 Å
• b: 20.4715 ± 0.0017 Å
• c: 21.2759 ± 0.0017 Å
• α: 91.246 ± 0.006°
• β: 109.931 ± 0.008°
• γ: 102.477 ± 0.007°
• Cell volume: 6749 ± 1.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.2687
• Residual factor for significantly intense reflections: 0.0862
• Weighted residual factors for significantly intense reflections: 0.0997
• Weighted residual factors for all reflections included in the refinement: 0.1421
• Goodness-of-fit parameter for all reflections included in the refinement: 0.807
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No