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Dr. Nan Xu, Lauren E. Goodrich, Dr. Nicolai Lehnert, Dr. Douglas R. Powell and Dr. George B. Richter-Addo Preparation of the Elusive [(por)Fe(NO)(O-ligand)] Complex by Diffusion of Nitric Oxide into a Crystal of the Precursor Angewandte Chemie International Edition 52

Version of Record online: 4 MAR 2013 | DOI: 10.1002/anie.201208063

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A crystal-gas method was used to prepare neutral [(por)Fe(NO)(O-ligand)] complexes. [(por)Fe(NO)(OC([DOUBLE BOND]O)CF3)] has an almost linear Fe[BOND]NO moiety. Porphyrin molecules move dramatically in the crystal upon NO diffusion into the lattice and binding to Fe. DFT calculations on this and related complexes provide insight into the trans effects of axial ligands on the Fe[BOND]NO angle.

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