Information card for entry 4346007

Structure parameters

• Formula: C30 H32 N4 O2 Pd2
• Calculated formula: C30 H32 N4 O2 Pd2
• SMILES: [Pd]123OC(=CC(=[N]1CCC13C=[N]([Pd]34[N](=C(C=C(O3)C)C)CCC34C=[N]2c2c3cccc2)c2c1cccc2)C)C
• Title of publication: Indole Rings in Palladium(II) Complexes. Dual Mode of Metal Binding and Aromatic Ring Stacking Causing syn-anti Isomerism
• Authors of publication: Masako Takani; Takeshi Takeda; Tatsuo Yajima; Osamu Yamauchi
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Pages of publication: 5938 - 5946
• a: 8.5016 ± 0.0016 Å
• b: 11.609 ± 0.002 Å
• c: 15.377 ± 0.003 Å
• α: 69.25 ± 0.009°
• β: 74.329 ± 0.009°
• γ: 70.879 ± 0.009°
• Cell volume: 1320.4 ± 0.4 ų
• Cell temperature: 103.1 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.039
• Weighted residual factors for all reflections included in the refinement: 0.078
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No