Information card for entry 7127423

Structure parameters

• Formula: C37 H52 Ge N2 P2 Pd S2
• Calculated formula: C37 H52 Ge N2 P2 Pd S2
• SMILES: CC(C)[P]1(C(C)C)Cc2ccc3C(C)(C)c4ccc5C[P](C(C)C)(C(C)C)[Pd]1([Ge](n23)(n45)Sc1ccccc1)Sc1ccccc1
• Title of publication: A Z-type PGeP pincer germylene ligand in a T-shaped palladium(0) complex.
• Authors of publication: Cabeza, Javier A.; García-Álvarez, Pablo; Laglera-Gándara, Carlos J; Pérez-Carreño, Enrique
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2020
• Journal volume: 56
• Journal issue: 90
• Pages of publication: 14095 - 14097
• a: 17.5001 ± 0.0004 Å
• b: 12.1142 ± 0.0002 Å
• c: 18.945 ± 0.0004 Å
• α: 90°
• β: 114.67 ± 0.001°
• γ: 90°
• Cell volume: 3649.75 ± 0.13 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.019
• Residual factor for significantly intense reflections: 0.0178
• Weighted residual factors for significantly intense reflections: 0.041
• Weighted residual factors for all reflections included in the refinement: 0.0418
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No