Information card for entry 1562300

Structure parameters

• Formula: C42 H32 Au Cl2 N O P2
• Calculated formula: C42 H32 Au Cl2 N O P2
• SMILES: [Cl-].[Au]1(Cl)([P](c2ccccc2[P]1(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1C(=O)c1ncccc1
• Title of publication: Anticancer gold(iii)-bisphosphine complex alters the mitochondrial electron transport chain to induce <i>in vivo</i> tumor inhibition.
• Authors of publication: Kim, Jong Hyun; Ofori, Samuel; Parkin, Sean; Vekaria, Hemendra; Sullivan, Patrick G.; Awuah, Samuel G.
• Journal of publication: Chemical science
• Year of publication: 2021
• Journal volume: 12
• Journal issue: 21
• Pages of publication: 7467 - 7479
• a: 12.0282 ± 0.0006 Å
• b: 16.7453 ± 0.0008 Å
• c: 20.3891 ± 0.0011 Å
• α: 97.253 ± 0.002°
• β: 95.135 ± 0.002°
• γ: 90.405 ± 0.002°
• Cell volume: 4056.8 ± 0.4 ų
• Cell temperature: 90 ± 0.2 K
• Ambient diffraction temperature: 90 ± 0.2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0727
• Residual factor for significantly intense reflections: 0.0529
• Weighted residual factors for significantly intense reflections: 0.155
• Weighted residual factors for all reflections included in the refinement: 0.1696
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No