Information card for entry 7039779

Structure parameters

• Formula: C52 H47 Cl2 F10 N4 O2 P Ru2
• Calculated formula: C52 H46 Cl2 F10 N4 O2 P Ru2
• SMILES: c12[n]([Ru]34567(N(C1=O)c1c(F)cc(F)cc1)([cH]1[cH]3[c]4([cH]5[cH]6[c]71C)C(C)C)Cl)c1ccccc1cc2.[P](F)(F)(F)(F)(F)[F-].c12ccccc1ccc1[n]2[Ru]23456(N(C1=O)c1c(F)cc(F)cc1)([cH]1[cH]2[c]3([cH]4[cH]5[c]61C)C(C)C)Cl
• Title of publication: Cytotoxic hydrogen bridged ruthenium quinaldamide complexes showing induced cancer cell death by apoptosis.
• Authors of publication: Lord, Rianne M.; Allison, Simon J.; Rafferty, Karen; Ghandhi, Laura; Pask, Christopher M.; McGowan, Patrick C.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 33
• Pages of publication: 13196 - 13203
• a: 9.425 ± 0.0001 Å
• b: 9.812 ± 0.0002 Å
• c: 14.623 ± 0.0002 Å
• α: 72.432 ± 0.001°
• β: 85.74 ± 0.001°
• γ: 74.827 ± 0.001°
• Cell volume: 1244.28 ± 0.03 ų
• Cell temperature: 148 ± 2 K
• Ambient diffraction temperature: 148.15 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0378
• Residual factor for significantly intense reflections: 0.0316
• Weighted residual factors for significantly intense reflections: 0.0771
• Weighted residual factors for all reflections included in the refinement: 0.08
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No