Information card for entry 4346920

Structure parameters

• Formula: C31.5 H37 N O5 P2 Pd S
• Calculated formula: C31.5 H37 N O5 P2 Pd S
• SMILES: [Pd]12(SC[C@H]([NH2]2)C(=O)[O-])[P](c2ccccc2)(CCC[P]1(c1ccccc1)c1ccccc1)c1ccccc1.OC.OC.O.O
• Title of publication: Methanol-Triggered Turn-On-Type Photoluminescence in L-Cysteinato Palladium(II) and Platinum(II) Complexes Supported by a Bis(diphenylphosphine) Ligand.
• Authors of publication: Yoshinari, Nobuto; Shimizu, Tsutomu; Nozaki, Koichi; Konno, Takumi
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 5
• Pages of publication: 2030 - 2036
• a: 13.1259 ± 0.0002 Å
• b: 18.8248 ± 0.0003 Å
• c: 27.4833 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6790.92 ± 0.19 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 7
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0475
• Residual factor for significantly intense reflections: 0.0433
• Weighted residual factors for significantly intense reflections: 0.1122
• Weighted residual factors for all reflections included in the refinement: 0.114
• Goodness-of-fit parameter for all reflections included in the refinement: 1.109
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No