Information card for entry 7710237

Structure parameters

• Formula: C24 H25 Hg N3 O P S
• Calculated formula: C24 H25 Hg N3 O P S
• Title of publication: Synthesis, structure and reactivity with phosphines of Hg(ii) ortho-cyano-aminothiophenolate complexes formed via C–S bond cleavage and dehydrogenation of 2-aminobenzothiazoles
• Authors of publication: Al-Jibori, Subhi A.; Irzoqi, Ahmed A.; Al-Janabi, Ahmed S. M.; Al-Nassiry, Amenah I. A.; Basak-Modi, Sucharita; Ghosh, Shishir; Wagner, Christoph; Hogarth, Graeme
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 10.1886 ± 0.0006 Å
• b: 10.8397 ± 0.0006 Å
• c: 12.3566 ± 0.0006 Å
• α: 76.019 ± 0.004°
• β: 71.357 ± 0.004°
• γ: 72.842 ± 0.004°
• Cell volume: 1219.06 ± 0.12 ų
• Cell temperature: 213 K
• Ambient diffraction temperature: 213 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: 0.0298
• Residual factor for significantly intense reflections: 0.0241
• Weighted residual factors for significantly intense reflections: 0.0558
• Weighted residual factors for all reflections included in the refinement: 0.0578
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No