Information card for entry 7016888

Structure parameters

• Formula: C23 H18 Cl2 F6 N3 Os P
• Calculated formula: C23 H18 Cl2 F6 N3 Os P
• SMILES: [Os]123456(Cl)([n]7c(Cl)cccc7N=[N]1c1ccccc1)[cH]1[cH]2[cH]3[cH]4[cH]5[c]61c1ccccc1.[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Structure-activity relationships for organometallic osmium arene phenylazopyridine complexes with potent anticancer activity.
• Authors of publication: Fu, Ying; Habtemariam, Abraha; Basri, Aida M. B. H.; Braddick, Darren; Clarkson, Guy J.; Sadler, Peter J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 40
• Pages of publication: 10553 - 10562
• a: 7.624 ± 0.0005 Å
• b: 28.9718 ± 0.0019 Å
• c: 11.0421 ± 0.0014 Å
• α: 90°
• β: 94.24 ± 0.008°
• γ: 90°
• Cell volume: 2432.3 ± 0.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 7
• 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: 0.0903
• Residual factor for significantly intense reflections: 0.0654
• Weighted residual factors for significantly intense reflections: 0.1748
• Weighted residual factors for all reflections included in the refinement: 0.1996
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No