Information card for entry 4331854

Structure parameters

• Formula: C22 H60 F6 N10 O12 P Pt2 Tl
• Calculated formula: C22 H60 F6 N10 O12 P Pt2 Tl
• SMILES: C1(C(C)(C)C)=[NH][Pt]2([NH]=C(O[Tl]342(O1)OC(C(C)(C)C)=[NH][Pt]4([NH]=C(C(C)(C)C)O3)([NH3])([NH3])ON(=O)=O)C(C)(C)C)([NH3])(ON(=O)=O)[NH3].[P](F)(F)(F)(F)(F)[F-].OC.OC
• Title of publication: Spectral and Structural Characterization of Amidate-Bridged Platinum−Thallium Complexes with Strong Metal−Metal Bonds
• Authors of publication: Chen, Wanzhi; Liu, Fenghui; Matsumoto, Kazuko; Autschbach, Jochen; Le Guennic, Boris; Ziegler, Tom; Maliarik, Mikhail; Glaser, Julius
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 11
• Pages of publication: 4526 - 4536
• a: 15.298 ± 0.012 Å
• b: 12.938 ± 0.01 Å
• c: 23.433 ± 0.017 Å
• α: 90°
• β: 105.299 ± 0.012°
• γ: 90°
• Cell volume: 4474 ± 6 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 8
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0852
• Residual factor for significantly intense reflections: 0.0734
• Weighted residual factors for significantly intense reflections: 0.1994
• Weighted residual factors for all reflections included in the refinement: 0.2209
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No