A Au(I)–N-heterocyclic-carbene (NHC)-edged Pd₆L₁₂ molecular metal–organic cage is assembled from a Au(I)–NHC-based bipyridyl bent ligand and Pd²⁺. The octahedral cage structure is unambiguously established by NMR, electrospray ionization-mass spectrometry and single crystal X-ray crystallography. The electrochemical behaviour was analyzed by cyclic voltammetry. The octahedral cage has a central cavity for guest binding, and is capable of encapsulating PF₆⁻ and BF₄⁻ anions within the cavity.