Information card for entry 7028484

Structure parameters

• Formula: C33 H42 Cl6 N6 O6 Zn3
• Calculated formula: C33 H42 Cl6 N6 O6 Zn3
• Title of publication: Halogen effects on photoluminescence and catalytic properties: a series of spatially arranged trimetallic zinc(ii) complexes.
• Authors of publication: Lee, Haeri; Noh, Tae Hwan; Jung, Ok-Sang
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 10
• Pages of publication: 3842 - 3849
• a: 32.1306 ± 0.0004 Å
• b: 32.1306 ± 0.0004 Å
• c: 7.388 ± 0.0001 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 6605.34 ± 0.15 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 173
• Hermann-Mauguin space group symbol: P 63
• Hall space group symbol: P 6c
• Residual factor for all reflections: 0.0585
• Residual factor for significantly intense reflections: 0.0448
• Weighted residual factors for significantly intense reflections: 0.0997
• Weighted residual factors for all reflections included in the refinement: 0.1045
• Goodness-of-fit parameter for all reflections included in the refinement: 1.064
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No