High-Frequency Fe–H and Fe–H2 Modes in a trans-Fe(η2‑H2)(H) Complex: A Speed Record for Nuclear Resonance Vibrational Spectroscopy

Nuclear resonance vibrational spectroscopy (NRVS) and density functional theory (DFT) are complementary tools for studying the vibrational and geometric structures of specific isotopically labeled molecular systems. Here we apply NRVS and DFT to characterize the trans-[57Fe­(η2-H2)­(H)­(dppe)2]­[BPh...

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Bibliographic Details
Published in:Inorganic Chemistry 2021-01, Vol.60 (2), p.555-559
Main Authors: Chiang, Ming-Hsi, Pelmenschikov, Vladimir, Gee, Leland B, Liu, Yu-Chiao, Hsieh, Chang-Chih, Wang, Hongxin, Yoda, Yoshitaka, Matsuura, Hiroaki, Li, Lei, Cramer, Stephen P
Format: Article
Language:eng ; jpn
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