Information card for entry 2224486

Structure parameters

• Chemical name: Diacetato{4'-[4-(benzyloxy)phenyl]-2,2':6',2''-terpyridine}zinc(II)
• Formula: C32 H27 N3 O5 Zn
• Calculated formula: C32 H27 N3 O5 Zn
• SMILES: c1cccc2c3cc(cc4c5cccc[n]5[Zn]([n]12)([n]34)(OC(=O)C)OC(=O)C)c1ccc(cc1)OCc1ccccc1
• Title of publication: Diacetato{4'-[4-(benzyloxy)phenyl]-2,2':6',2''-terpyridine}zinc(II)
• Authors of publication: Li, Wei; Lu, Zhan Guo
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 12
• Pages of publication: m1672
• a: 8.3959 ± 0.0017 Å
• b: 15.564 ± 0.003 Å
• c: 10.702 ± 0.002 Å
• α: 90°
• β: 102.23 ± 0.03°
• γ: 90°
• Cell volume: 1366.7 ± 0.5 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 5
• Space group number: 7
• Hermann-Mauguin space group symbol: P 1 n 1
• Hall space group symbol: P -2yac
• Residual factor for all reflections: 0.0841
• Residual factor for significantly intense reflections: 0.0367
• Weighted residual factors for significantly intense reflections: 0.0802
• Weighted residual factors for all reflections included in the refinement: 0.106
• Goodness-of-fit parameter for all reflections included in the refinement: 0.981
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes