Information card for entry 7050587

Structure parameters

• Formula: C37.13 H34.25 Cl0.25 N3 O5 P Pd
• Calculated formula: C37.125 H34.25 Cl0.25 N3 O5 P Pd
• Title of publication: Solid state conformational and theoretical study of complexes containing the (CxN)Pd moiety (CxN = 2-(phenylazo)phenyl-C,N and its derivatives)
• Authors of publication: José Pérez; Luis García; Eduardo Pérez; José Luis Serrano; José Francisco Martínez; Gregorio Sánchez; Gregorio López; Arturo Espinosa; Malva Liu; Franciso Sanz
• Journal of publication: New J. Chem.
• Year of publication: 2003
• Journal volume: 27
• Journal issue: 10
• Pages of publication: 1490 - 1496
• a: 15.001 ± 0.0002 Å
• b: 15.741 ± 0.0002 Å
• c: 18.139 ± 0.0003 Å
• α: 92.767 ± 0.0006°
• β: 105.623 ± 0.0007°
• γ: 114.954 ± 0.0005°
• Cell volume: 3675.01 ± 0.09 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1071
• Residual factor for significantly intense reflections: 0.0531
• Weighted residual factors for significantly intense reflections: 0.1503
• Weighted residual factors for all reflections included in the refinement: 0.1849
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No