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DFT/ECP Study of C-H Activation by (PCP)Ir and (PCP)Ir(H)2 (PCP = η3-1,3-C6H3(CH2PR2)2). Enthalpies and Free Energies of Associative and Dissociative Pathways

✍ Scribed by Krogh-Jespersen, K.; Czerw, M.; Kanzelberger, M.; Goldman, A.S.

No coin nor oath required. For personal study only.

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