Information card for entry 4345645

Structure parameters

• Formula: C35 H45 N O3 Pt S
• Calculated formula: C35 H45 N O3 Pt S
• SMILES: [Pt]12(c3c(c4[n]1cc(c1sccc1)c1c4CCC1)ccc(OCCCCCCCCCCCC)c3)OC(=CC(=[O]2)C)C
• Title of publication: Tuning the Excimer Emission of Amphiphilic Platinum(II) Complexes Mediated by Phospholipid Vesicles.
• Authors of publication: Shafikov, Marsel Z.; Suleymanova, Alfiya F.; Kozhevnikov, Dmitry N.; König, Burkhard
• Journal of publication: Inorganic chemistry
• Year of publication: 2017
• Journal volume: 56
• Journal issue: 9
• Pages of publication: 4885 - 4897
• a: 6.98029 ± 0.00013 Å
• b: 7.6854 ± 0.00015 Å
• c: 32.2691 ± 0.0005 Å
• α: 90.599 ± 0.0015°
• β: 94.8494 ± 0.0014°
• γ: 107.467 ± 0.0017°
• Cell volume: 1644.22 ± 0.05 ų
• Cell temperature: 293 ± 1 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0555
• Residual factor for significantly intense reflections: 0.0412
• Weighted residual factors for significantly intense reflections: 0.0816
• Weighted residual factors for all reflections included in the refinement: 0.0877
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1136
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No