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Table A.2

Infrared fitting parameters.

Band positions Integrated vibrational modes
Flame Distance ωc(C=C) ωcsp3 Δ(CC–sp3) CHarom. CH3,aliph. CH2,aliph. CH3,Fermi. C=O C=C sp3 sp2 solo
C/O [mm] [cm-1] [cm-1] [cm-1] [cm-1] [cm-1] [cm-1] [cm-1] [cm-1] [cm-1] [cm-1] [cm-1]
20 1595 1247 348 0.05 0.10 0.10 0.10 0.63 0.41 1.97 0.40
0.82 21 1593 1243 350 0.03 0.06 0.07 0.08 0.48 0.33 0.98 0.13
22 1593 1242 351 0.04 0.09 0.07 0.06 0.53 0.39 1.86 0.34
30 1590 1232 358 0.02 0.04 0.06 0.08 0.41 0.38 1.67 0.26
18 1599 1280 319 0.03 0.06 0.04 0.02 0.18 0.08 0.15 NA
21 1601 1280 321 0.03 0.06 0.05 0.04 0.18 0.14 0.18 NA
1 25 1592 1262 330 0.37 0.28 0.35 0.24 2.48 2.86 4.58 0.56
30 1587 1242 346 0.25 0.15 0.16 0.19 1.44 2.33 4.70 0.23
39 1582 1219 363 0.32 0.01 0.06 0.06 0.72 2.49 6.79 0.50
14 1595 1274 321 0.07 0.04 0.04 0.02 0.33 0.20 0.27 NA
1.05 18 1602 1275 327 0.03 0.03 0.05 0.02 0.14 0.16 0.45 NA
22 1593 1269 324 0.01 0.02 0.03 0.02 0.07 0.14 0.25 NA
22 1596 1262 334 0.23 0.19 0.25 0.16 2.03 2.02 4.27 0.09
24 1592 1251 341 0.23 0.20 0.21 0.26 2.70 3.20 6.80 0.11
26 1588 1240 349 0.15 0.08 0.13 0.19 2.60 3.53 8.86 0.23
28 1587 1230 357 0.11 0.04 0.07 0.10 1.42 2.69 6.72 0.16
1.05 30 1586 1225 360 0.11 0.03 0.06 0.08 1.03 2.47 6.55 0.17
32 1582 1217 365 0.11 0.03 0.08 0.06 0.73 2.30 7.06 0.32
34 1579 1213 366 0.12 0.03 0.12 0.12 1.07 2.19 9.51 1.39
36 1579 1195 384 0.22 0.31 0.67 0.30 1.71 3.42 16.14 1.80
42 1579 1191 389 0.12 0.04 0.10 0.11 1.72 2.58 9.08 0.42
50 1575 1179 396 0.15 0.04 0.12 0.16 2.25 2.47 9.55 0.47
25 1590 1267 323 0.11 0.01 0.01 0.00 0.73 0.45 0.49 0.20
27 1593 1261 332 0.22 0.03 0.07 0.05 0.64 0.40 0.50 0.19
1.3 30 1600 1275 326 0.25 0.03 0.07 0.04 0.57 0.50 0.48 0.17
33 1598 1273 325 0.57 0.06 0.12 0.10 0.69 0.83 0.61 0.48
36 1601 1276 325 0.59 0.05 0.21 0.08 0.83 1.22 0.90 0.61
39 1597 1279 318 0.25 0.04 0.09 0.06 0.57 0.60 0.46 0.21
a-C:H NA 1625 NA NA 0.08 0.38 0.44 0.15 0.69 0.03 NA NA

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