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. Author manuscript; available in PMC: 2019 Nov 28.
Published in final edited form as: Chem Rev. 2018 Oct 29;118(22):10840–11022. doi: 10.1021/acs.chemrev.8b00074

Table 8.

Tabulated Soret and Q-Band Values for Heme and Heme-Copper Complexes in Both Protein and Synthetic Model Systems

entry no. complex Soret band (nm) Q-band (nm) ref
ferric superoxidef
(1) Oxy-Mb 415 541, 577 1167 and 1168
(2) Oxy-Hb 418 544, 582 1169
(3) Oxy-Cyt P450 417 556, 580(sh) 1170
(4) Oxy-CPOa,b 428 553, 587 1171
(5) [(THF)(F8)FeIII-(O2• −)] 416 536 498
(6) [(PIm)FeIII-(O2• −)] 423 534 420
(7) [(PPy)FeIII-(O2• −)]b 419 555 420
(8) [(6L)FeIII-O2• −] 422 542 504
(9) [(6L)FeIII-O2• − FeII-Cl] 418 536 1149
(10) [(TMPIm)FeIII-(O2• −)-CuI(LN4-OH)]+b 425 550, 590 485
(11) [(TMPImXO2Et)FeIII(O2• −)]b 428 550, 592 122
(12) [(NMePr)FeIII-(O2• −)-CuI)+b 422 542 524
(13) [(MeTHF)(F8)FeIII-O2·−] 416 535 497
(14) [(TMP)FeIII(O2• −)···CuI(LN3-OH)] 414 935
(15) [α4-Fe(CO2Me)4)-O2• −] 522, 545 1237
(16) [(S4-FeFc4)-O2• −] 425 522, 545, 584 1238
(17) [(α4-FeEs4)-O2• −] 426 543 1238
ferric peroxides
(18) Mb-(O22−) 433 540, 567 571
(19) Cyt. P450-(O22−) 439 530, 561 574
(20) [(TMPImXO2Et)FeIII(O22−)] 430 568, 610 122
(21) [(TMPIm)FeIII(O22−)] 440 574, 615 490
(22) [(TMP)FeIII(O22−)] 439 569, 614 490
(23) [(TPP)FeIII(O22−)] 437 565, 610 539
(24) [(OEP)FeIII(O22−)] 423 543, 573 539
(25) [(F8)FeIII(O22−)] 435 540, 560 495
ferric hydroperoxide
(26) Mb-(OOH) 413 ~540, 573 1172
(27) HRP-(OOH)c 419 526, 556 1173
(28) HO-(OOH)d 421 530, 557 180
(29) CPO-(OOH) 449 546, 576 1171
(30) Cyt P450-(OOH) 437 ~530, 561 574
(31) [(TMPIm)FeIII-OOH] 428 532, 562, 608 490
(32) [(TMPImXO2Et)FeIII-OOH] 429 566, 608 122
(33) [(TMPImAOH)FeIII-OOH] 429 538, 568 568
(34) [(TMPImAOEt)FeIII-OOH] 430 570, 610 568
high-spin heme-copper(L)3 peroxos 938
(35) [(2L)FeIII-(O22−)-CuII] + 419 488, 544, 575 938
(36) [(TMP)FeIII-(O22−)-CuII(LN3-H)] + 419 543 935
(37) [(TMP)FeIII-(O22−)-CuII(LN3-ONa)] + N.R. 546, 570 935
(38) [(F8)FeIII-(O22−)-CuII(AN)] + 418 538, 561 516
(39) [(F8)FeIII-(O22−)-CuII(LMe2N)]+ 420 540, 567 513
(40) [(F8)FeIII-(O22−)-CuII(MeTHF)3]+ 418 480, 538, 565 497
low-spin heme-copper(L)3 peroxos
(41) [(DCHIm)(F8)FeIII-(O22−)-CuII(ANE)] + 421 535 928
(42) [(DCHIm)(F8)FeIII-(O22−)-CuII(DCHIm)3] + 421 531 497
high-spin heme-copper(L)4 peroxos
(43) [(TPP)FeIII-(O22−)-CuII(tpa)] + 420 557, 612 934
(44) [(TPP)FeIII-(O22−)-CuII(5-Metpa)]+ 930
(45) [(TMP)FeIII-(O22−)-CuII(5-Metpa)] + 420 557, 612 931
(46) [(TMP)FeIII-(O22−)-CuII(LOH)] + 429 558, 612 486 and 935
(47) [(TMP)FeIII-(O22−)-CuII(LOMOM)] + 421 557, 615 935
(48) (6L)FeIII-(O22−)-CuII] + 418 561, 632 936
(49) [(sL)FeIII-(O22−-)-CuII] + 936
(50) [(F8)FeIII-(O22−)-CuII(TMPA)] + 418 560 498
(51) [(F8)FeIII-(O22−)-CuII(LN4OH)] + 417 560 937
(52) [(F8)FeIII-(O22−)-CuII(LN4OMe)] + 937
low-spin hem-copper(L) 4 peroxos
(53) [(DCHIm)(TACNAcr)FeIII-(O22−)-CuII] + 428 933
(54) [(TMPIm)FeIII-(O22−)-CuII(LN4-OH)]+ 429 538 485
(55) [(TMPIm)FeIII-(O22−)-CuII(LN4-OMOM)] + 429 537 485
(56) [(DCHIm)(F8)FeIII-(O22−)-CuII(TMPA)] + 426 535 497
(57) [(DCHIm)(F8)FeIII-(O22−)-CuII(DCHIm)4] + 423 537 497
carbonyl
(58) Hb-CO 419 539, 569 1174
cytochrome c oxidase
(59) Oxy-CcO 425 591 1164 and 1166
(60) CO-CcO 430 589 1164 and 1166
a

Chloroperoxidase.

b

v(O-O) not reported.

c

Horseradish peroxidase.

d

Heme oxygenase.

e

Not reported.

f

See also the “Note Added in Proof’, for reference to additional examples.