Information card for entry 7005263

Structure parameters

• Common name: (3,5,6-tri-O-(2-picolyl)-1,2-isopropylidene-alpha-L- glucofuranose Co(ii)) (PF6)2
• Chemical name: [3,5,6-tri-O-(2-picolyl)-1,2-isopropylidene-α-L-glucofuranose Co(II)] (PF6)2
• Formula: C27 H33 Co F12 N3 O7 P2
• Calculated formula: C27 H31 Co F12 N3 O7 P2
• SMILES: [Co]12345[O]([C@H]6[C@@H]7OC(O[C@@H]7O[C@H]6[C@@H]([O]1Cc1[n]4cccc1)C[O]2Cc1[n]5cccc1)(C)C)Cc1[n]3cccc1.O.[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Glycoligands and Co(II) glycocomplexes. Investigation of the variation of the sugar-scaffold on the structure and chirality measured by circular dichroism.
• Authors of publication: Cisnetti, Federico; Guillot, Régis; Desmadril, Michel; Pelosi, Giorgio; Policar, Clotilde
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2007
• Journal issue: 15
• Pages of publication: 1473 - 1476
• a: 9.1512 ± 0.0007 Å
• b: 19.1282 ± 0.0015 Å
• c: 10.0022 ± 0.0008 Å
• α: 90°
• β: 104.159 ± 0.001°
• γ: 90°
• Cell volume: 1697.7 ± 0.2 ų
• Cell temperature: 100 ± 1 K
• Ambient diffraction temperature: 100 ± 1 K
• Number of distinct elements: 7
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0652
• Residual factor for significantly intense reflections: 0.0491
• Weighted residual factors for significantly intense reflections: 0.1152
• Weighted residual factors for all reflections included in the refinement: 0.1213
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No