Information card for entry 7044852

Structure parameters

• Formula: C34 H36 F12 N6 O2 P2 Ru S2
• Calculated formula: C34 H36 F12 N6 O2 P2 Ru S2
• Title of publication: Controlling with light the interaction between trans-tetrapyridyl ruthenium complexes and an oligonucleotide.
• Authors of publication: van Rixel, Vincent H. S.; Moolenaar, Geri F.; Siegler, Maxime A.; Messori, Luigi; Bonnet, Sylvestre
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 2
• Pages of publication: 507 - 516
• a: 9.54745 ± 0.00018 Å
• b: 21.8432 ± 0.0004 Å
• c: 18.4565 ± 0.0003 Å
• α: 90°
• β: 98.2773 ± 0.0017°
• γ: 90°
• Cell volume: 3808.95 ± 0.12 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0333
• Residual factor for significantly intense reflections: 0.0291
• Weighted residual factors for significantly intense reflections: 0.0943
• Weighted residual factors for all reflections included in the refinement: 0.0963
• Goodness-of-fit parameter for all reflections included in the refinement: 0.987
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No