Information card for entry 7715682

Structure parameters

• Formula: C42 H48 Au2 Cl2 O3 P2
• Calculated formula: C42 H48 Au2 Cl2 O3 P2
• SMILES: [Au](Cl)[P](Oc1cc(O[P]([Au]Cl)(c2ccccc2)c2ccccc2)c(cc1C(C)(C)C)C(C)(C)C)(c1ccccc1)c1ccccc1.O1CCCC1
• Title of publication: Diverse structural reactivity patterns of a POCOP ligand with coinage metals.
• Authors of publication: Ghosh, Moushakhi; Parvin, Nasrina; Panwaria, Prakash; Tothadi, Srinu; Bakthavatsalam, Rangarajan; Therambram, Arshad; Khan, Shabana
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 18
• Pages of publication: 7763 - 7774
• a: 21.921 ± 0.009 Å
• b: 16.939 ± 0.007 Å
• c: 24.632 ± 0.009 Å
• α: 90°
• β: 96.918 ± 0.013°
• γ: 90°
• Cell volume: 9080 ± 6 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• 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: 0.0574
• Residual factor for significantly intense reflections: 0.0358
• Weighted residual factors for significantly intense reflections: 0.0709
• Weighted residual factors for all reflections included in the refinement: 0.0808
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No