(23) The connectivity of this complex is supported by X-ray diffraction study, the quality of which prevent its publication, particular, a cis-arrangement around the Pd(II) is confirmed (Figure S7), pp.4362-4384, 1980. ,
Transition Metal Complexes Structures and Spectra (27) CAM-B3LYP unexpectedly gives too high excitation energies for the series, including L1 itself ? see data in the SI. (28) The B3LYP optimization, resulted in a structure, with the two ligands being rotated away by about 30°, Inorg. Chem. Synth Structure and Bonding Chem. Rev. Chem. Rev. J. Mater. Chem, vol.27, issue.4, pp.4007-4048, 1984. ,
Program for the Refinement of Crystal Structures (33) International Tables for X-ray Crystallography, Phys. Rev. A Chem. Phys. Lett. Chem. Phys. Lett.. B, vol.32, issue.393, pp.115-147, 1988. ,
Theor Chem Accounts, Phys Chem Chem Phys J. Molec. Graphics, vol.09, issue.14, pp.215-241, 1996. ,