Information card for entry 7053375

Structure parameters

• Formula: C42 H64 Br2 N2 O4 S2
• Calculated formula: C42 H64 Br2 N2 O4 S2
• SMILES: C(/C=C/CN(C/C=C/CN(C/C=C/CBr)S(=O)(=O)c1c(cc(cc1C(C)C)C(C)C)C(C)C)S(=O)(=O)c1c(cc(cc1C(C)C)C(C)C)C(C)C)Br
• Title of publication: An efficient synthesis combining phosphorus dendrimers and 15-membered triolefinic azamacrocycles: towards the stabilization of platinum nanoparticles
• Authors of publication: Franc, Grégory; Badetti, Elena; Duhayon, Carine; Coppel, Yannick; Turrin, Cédric-Olivier; Majoral, Jean-Pierre; Sebastián, Rosa-María; Caminade, Anne-Marie
• Journal of publication: New Journal of Chemistry
• Year of publication: 2010
• Journal volume: 34
• Journal issue: 3
• Pages of publication: 547
• a: 6.265 ± 0.005 Å
• b: 12.133 ± 0.005 Å
• c: 15.07 ± 0.005 Å
• α: 101.754 ± 0.005°
• β: 96.69 ± 0.005°
• γ: 93.917 ± 0.005°
• Cell volume: 1108.9 ± 1.1 ų
• Cell temperature: 180 K
• Ambient diffraction temperature: 180 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: 0.0576
• Residual factor for significantly intense reflections: 0.033
• Weighted residual factors for all reflections: 0.0425
• Weighted residual factors for significantly intense reflections: 0.0377
• Weighted residual factors for all reflections included in the refinement: 0.0377
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1095
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No