Information card for entry 7111354

Structure parameters

• Formula: C66 H62 N4 O4 P2 Pt
• Calculated formula: C66 H62 N4 O4 P2 Pt
• SMILES: C(#Cc1ccc(C2=N(=O)C(C)(C)C([N]2=O)(C)C)cc1)[Pt]([P](c1ccccc1)(c1ccccc1)c1ccccc1)(C#Cc1ccc(cc1)C1=N(=O)C(C)(C)C([N]1=O)(C)C)[P](c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Intramolecular exchange interaction in twofold spin-labelled platinum complexes
• Authors of publication: Stroh, Christophe; Mayor, Marcel; von H�nisch, Carsten; Turek, Philippe
• Journal of publication: Chemical Communications
• Year of publication: 2004
• Journal issue: 18
• Pages of publication: 2050 - 2051
• a: 34.963 ± 0.007 Å
• b: 9.4928 ± 0.0019 Å
• c: 19.323 ± 0.004 Å
• α: 90°
• β: 119.33 ± 0.03°
• γ: 90°
• Cell volume: 5591 ± 3 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 6
• 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: 0.0452
• Residual factor for significantly intense reflections: 0.0362
• Weighted residual factors for significantly intense reflections: 0.0984
• Weighted residual factors for all reflections included in the refinement: 0.1018
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No