title: Theoretical studies for large tunneling and the hydrogen-transfer mechanism in the C-H activation of CH3CN by a di(μ-oxo)diiron(IV) complex: a model for intermediate Q in soluble methane monooxygenase.
authors: Department of Applied Chemistry, Kyung Hee University, 1 Seochun-Dong, Giheung-Gu, Yongin-Si, Gyeonggi-Do, 446-701, Korea.
authors: Binh
authors: B
authors: Khanh Mai
authors: Yongho
authors: Y
authors: Kim
mesh_terms: D000097:Acetonitriles / Q000737:chemistry* / Q000378:metabolism; D014450:Electron Transport Complex III / Q000737:chemistry* / Q000378:metabolism; D005290:Ferric Compounds / Q000737:chemistry*; D006859:Hydrogen / Q000737:chemistry* / Q000378:metabolism; D008958:Models, Molecular; D008968:Molecular Conformation; D010105:Oxygenases / Q000737:chemistry* / Q000378:metabolism; D011789:Quantum Theory; D012995:Solubility
chemical_list: D000097:Acetonitriles; D005290:Ferric Compounds; C000499:ferric oxide; D006859:Hydrogen; D010105:Oxygenases; C021555:methane monooxygenase; D014450:Electron Transport Complex III; C032159:acetonitrile