Information card for entry 7046694

Structure parameters

• Formula: C18 H28 N2 O4 S4 Zn
• Calculated formula: C18 H28 N2 O4 S4 Zn
• Title of publication: An innovative and efficient route to the synthesis of metal-based glycoconjugates: proof-of-concept and potential applications.
• Authors of publication: Pettenuzzo, Andrea; Montagner, Diego; McArdle, Patrick; Ronconi, Luca
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 31
• Pages of publication: 10721 - 10736
• a: 9.4775 ± 0.0007 Å
• b: 10.8781 ± 0.0008 Å
• c: 12.1158 ± 0.0009 Å
• α: 81.181 ± 0.006°
• β: 72.125 ± 0.006°
• γ: 81.757 ± 0.006°
• Cell volume: 1168.58 ± 0.16 ų
• Cell temperature: 299 ± 0.2 K
• Ambient diffraction temperature: 299 ± 0.2 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: 0.095
• Residual factor for significantly intense reflections: 0.047
• Weighted residual factors for significantly intense reflections: 0.0984
• Weighted residual factors for all reflections included in the refinement: 0.1211
• Goodness-of-fit parameter for all reflections included in the refinement: 0.857
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No