Information card for entry 7062753

Structure parameters

• Formula: C45.5 H36 Au Cl F3 N2 O3 P S
• Calculated formula: C45.5 H36 Au Cl F3 N2 O3 P S
• Title of publication: Gold(i) complexes with redox active BIAN and MIAN ligands: synthesis, structure and electrochemistry
• Authors of publication: Bardina, Elena E.; Shmelev, Nikita Y.; Albrekht, Yana N.; Koon, Winnie Ka Yiu; Abramov, Pavel A.; Mirzaeva, Irina V.; Sheven’, Dmitriy G.; Makotchenko, Evgeniya V.; Fomenko, Iakov S.; Lukoyanov, Anton N.; Sokolov, Maxim N.; Babak, Maria V.; Gushchin, Artem L.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2023
• Journal volume: 47
• Journal issue: 39
• Pages of publication: 18251 - 18259
• a: 11.1358 ± 0.0004 Å
• b: 11.5238 ± 0.0005 Å
• c: 17.4708 ± 0.0007 Å
• α: 104.247 ± 0.002°
• β: 95.59 ± 0.002°
• γ: 104.326 ± 0.002°
• Cell volume: 2075.31 ± 0.15 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 9
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0756
• Residual factor for significantly intense reflections: 0.0535
• Weighted residual factors for significantly intense reflections: 0.1182
• Weighted residual factors for all reflections included in the refinement: 0.128
• Goodness-of-fit parameter for all reflections included in the refinement: 1.013
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No