Information card for entry 7106338

Structure parameters

• Formula: C12 H8 Cl4 N2 Re
• Calculated formula: C12 H8 Cl4 N2 Re
• SMILES: [Re]1(Cl)(Cl)(Cl)(Cl)[n]2c3c4[n]1cccc4ccc3ccc2
• Title of publication: Rhenium(IV) compounds inducing apoptosis in cancer cells
• Authors of publication: Jose Martinez-Lillo; Teresa F. Mastropietro; Rosamaria Lappano; Antonio Madeo; Marta E. Alberto; Nino Russo; Marcello Maggiolini; Giovanni De Munno
• Journal of publication: Chem.Commun.
• Year of publication: 2011
• Journal volume: 47
• Pages of publication: 5283
• a: 7.5973 ± 0.0002 Å
• b: 18.9753 ± 0.0006 Å
• c: 10.3352 ± 0.0003 Å
• α: 90°
• β: 108.249 ± 0.001°
• γ: 90°
• Cell volume: 1415 ± 0.07 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0789
• Residual factor for significantly intense reflections: 0.0721
• Weighted residual factors for significantly intense reflections: 0.1809
• Weighted residual factors for all reflections included in the refinement: 0.186
• Goodness-of-fit parameter for all reflections included in the refinement: 1.09
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No