Information card for entry 7061097

Structure parameters

• Formula: C28 H36 Cl2 N3 O P Pd
• Calculated formula: C28 H36 Cl2 N3 O P Pd
• Title of publication: Coordination behaviour of a hybrid phosphinoguanidine ligand
• Authors of publication: Leitner, Zdeněk; Císařová, Ivana; Štěpnička, Petr
• Journal of publication: New Journal of Chemistry
• Year of publication: 2022
• Journal volume: 46
• Journal issue: 3
• Pages of publication: 1060 - 1071
• a: 8.573 ± 0.0005 Å
• b: 32.934 ± 0.002 Å
• c: 21.093 ± 0.0014 Å
• α: 90°
• β: 96.416 ± 0.003°
• γ: 90°
• Cell volume: 5918.2 ± 0.6 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0296
• Residual factor for significantly intense reflections: 0.0224
• Weighted residual factors for significantly intense reflections: 0.0491
• Weighted residual factors for all reflections included in the refinement: 0.0518
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No