TY - JOUR
T1 - Erratum
T2 - Co(salophen)-Catalyzed Aerobic Oxidation of p-Hydroquinone: Mechanism and Implications for Aerobic Oxidation Catalysis (J. Am. Chem. Soc. (2016) 138: 12 (4186-4193) DOI: 10.1021/jacs.6b00254)
AU - Anson, Colin W.
AU - Ghosh, Soumya
AU - Hammes-Schiffer, Sharon
AU - Stahl, Shannon S.
N1 - Publisher Copyright:
© 2020 American Chemical Society. All rights reserved.
PY - 2020/12/30
Y1 - 2020/12/30
N2 - Page 4191. We recently identified an error in our data analysis spreadsheet that led to an inadvertent shift in the free energies of certain calculated structures by 1.5 kcal/mol. This shift does not change any of the analysis or conclusions of the paper but alters the quantitative values in the free energy diagram for structures 3 and beyond, shown in Scheme 4 in the main paper. The revised pathway is shown below. Supporting Information, page S12. All entries of the last column (column 6) in Table S7 starting with structure 3 (row 10 and beyond) should be increased by 1.5 kcal/mol, accounting for round-off error. The revised table is provided here.
AB - Page 4191. We recently identified an error in our data analysis spreadsheet that led to an inadvertent shift in the free energies of certain calculated structures by 1.5 kcal/mol. This shift does not change any of the analysis or conclusions of the paper but alters the quantitative values in the free energy diagram for structures 3 and beyond, shown in Scheme 4 in the main paper. The revised pathway is shown below. Supporting Information, page S12. All entries of the last column (column 6) in Table S7 starting with structure 3 (row 10 and beyond) should be increased by 1.5 kcal/mol, accounting for round-off error. The revised table is provided here.
UR - http://www.scopus.com/inward/record.url?scp=85098843249&partnerID=8YFLogxK
UR - http://www.scopus.com/inward/citedby.url?scp=85098843249&partnerID=8YFLogxK
U2 - 10.1021/jacs.0c11959
DO - 10.1021/jacs.0c11959
M3 - Comment/debate
C2 - 33319551
AN - SCOPUS:85098843249
SN - 0002-7863
VL - 142
SP - 21948
EP - 21949
JO - Journal of the American Chemical Society
JF - Journal of the American Chemical Society
IS - 52
ER -