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. Author manuscript; available in PMC: 2022 Sep 30.
Published in final edited form as: ACS Catal. 2021 Aug 3;11(16):10267–10278. doi: 10.1021/acscatal.1c02132

Table 1.

Relevant structural and spectroscopic parameters.

Sample Nε-Nε (Å) Cu-Nε (Å) λmax (nm) (ε / M−1cm−1) Kd (fM) Cu(I)/Cu(II) gx, gy gz Ax, Ay (MHz) Az (MHz)
[3SCC-Cu(I9H)3]2+ 3.41 2.03 590 (78) 12 / 184 2.05 2.25 116 566
[3SCC-Cu(I9H)3]2+ + H2O2 -- -- 330 (6400)
387 (1400)
570 (75)
-- 2.06 2.27 97 530
[3SCC-Cu(I9H)3]+ + H2O2 -- -- 350 (11530)
440 (460)
-- 2.06 2.28 100 497