! First column: pressure (atm), second column: pre-exponential parameter (cm3 s-1 or s-1), ! third column: exponent of T, fourth column: exponential parameter (cal/mol) ! k(T) = A * T^m * exp(-Ea/RT) ! N2 bath gas, temperature range: 200–500 K R => Int1 (Propan-2-oneoxide (DMCI) => Prop-1-en-2-peroxol) PLOG/ 0.00986922 8.019E23 -7.987 4672/ PLOG/ 0.0197384 2.085E23 -7.644 4785/ PLOG/ 0.0493461 1.752E22 -7.073 4913/ PLOG/ 0.0986922 1.361E21 -6.528 4983/ PLOG/ 0.197384 5.006E19 -5.863 5017/ PLOG/ 0.493461 1.475E17 -4.754 4978/ PLOG/ 0.986922 4.466E14 -3.698 4861/ PLOG/ 1.97384 3.044E11 -2.415 4641/ PLOG/ 4.93461 1.245E6 -0.2987 4144/ PLOG/ 9.86922 9.625 1.659 3582/ PLOG/ 19.7384 9.757E-6 3.918 2849/ PLOG/ 49.3461 1.238E-14 7.224 1670/ PLOG/ 98.6922 1.309E-21 9.789 688.9/ R => Int2 (Propan-2-oneoxide (DMCI) => 1-Hydroxypropan-2-one) PLOG/ 0.00986922 5.063E-10 4.700 908.1/ PLOG/ 0.0197384 6.968E-13 5.754 571.3/ PLOG/ 0.0493461 1.968E-16 7.075 212.2/ PLOG/ 0.0986922 7.851E-19 7.981 28.85/ PLOG/ 0.197384 6.728E-21 8.778 -61.45/ PLOG/ 0.493461 5.076E-23 9.627 -19.66/ PLOG/ 0.986922 3.947E-24 10.10 139.0/ PLOG/ 1.97384 7.744E-25 10.44 400.1/ PLOG/ 4.93461 2.499E-25 10.74 864.9/ PLOG/ 9.86922 1.296E-25 10.93 1254/ PLOG/ 19.7384 3.850E-26 11.20 1606/ PLOG/ 49.3461 9.119E-28 11.87 1889/ PLOG/ 98.6922 4.834E-30 12.72 1878/ R => P (Propan-2-oneoxide (DMCI) => Propan-2-on-1-yl + hydroxyl) PLOG/ 0.00986922 0.7784 2.680 5083/ PLOG/ 0.0197384 3.699E-4 3.918 4650/ PLOG/ 0.0493461 1.262E-8 5.567 4070/ PLOG/ 0.0986922 8.147E-12 6.749 3670/ PLOG/ 0.197384 1.159E-14 7.812 3347/ PLOG/ 0.493461 1.223E-17 8.945 3093/ PLOG/ 0.986922 3.870E-19 9.542 3067/ PLOG/ 1.97384 6.486E-20 9.891 3205/ PLOG/ 4.93461 7.182E-20 9.985 3634/ PLOG/ 9.86922 3.193E-19 9.845 4110/ PLOG/ 19.7384 2.205E-18 9.638 4648/ PLOG/ 49.3461 9.672E-18 9.519 5294/ PLOG/ 98.6922 3.287E-18 9.747 5599/ Int1 => Int2 (Prop-1-en-2-peroxol => 1-Hydroxypropan-2-one) PLOG/ 0.00986922 1.474E43 -10.99 2.166E4/ PLOG/ 0.0197384 1.651E43 -10.92 2.178E4/ PLOG/ 0.0493461 1.477E43 -10.79 2.192E4/ PLOG/ 0.0986922 7.576E42 -10.61 2.197E4/ PLOG/ 0.197384 1.686E42 -10.32 2.195E4/ PLOG/ 0.493461 1.309E41 -9.864 2.187E4/ PLOG/ 0.986922 1.089E40 -9.446 2.175E4/ PLOG/ 1.97384 6.316E38 -8.982 2.159E4/ PLOG/ 4.93461 1.123E37 -8.340 2.133E4/ PLOG/ 9.86922 5.567E35 -7.870 2.112E4/ PLOG/ 19.7384 3.493E34 -7.440 2.092E4/ PLOG/ 49.3461 1.602E33 -6.965 2.069E4/ PLOG/ 98.6922 2.619E32 -6.687 2.056E4/ Int1 => P (Prop-1-en-2-peroxol => Propan-2-on-1-yl + hydroxyl) PLOG/ 0.00986922 1.206E41 -10.33 2.284E4/ PLOG/ 0.0197384 9.682E41 -10.47 2.298E4/ PLOG/ 0.0493461 4.780E42 -10.51 2.316E4/ PLOG/ 0.0986922 6.677E42 -10.42 2.327E4/ PLOG/ 0.197384 4.862E42 -10.25 2.336E4/ PLOG/ 0.493461 7.472E41 -9.807 2.340E4/ PLOG/ 0.986922 6.260E40 -9.327 2.335E4/ PLOG/ 1.97384 1.948E39 -8.710 2.322E4/ PLOG/ 4.93461 4.599E36 -7.693 2.292E4/ PLOG/ 9.86922 1.911E34 -6.802 2.260E4/ PLOG/ 19.7384 4.994E31 -5.854 2.222E4/ PLOG/ 49.3461 1.837E28 -4.614 2.168E4/ PLOG/ 98.6922 7.546E25 -3.760 2.129E4/ !Canonical (high-pressure limit) rate coefficients, temperature range: 200–500 K !unimolecular R => Int1 (Propan-2-oneoxide (DMCI) => Prop-1-en-2-peroxol) 1.329E-37 15.84 -1084 Int1 => Int2 (Prop-1-en-2-peroxol => 1-Hydroxypropan-2-one) 1.06E31 -6.195 2.032E4 Int1 => P (Prop-1-en-2-peroxol => Propan-2-on-1-yl + hydroxyl) 9.675E18 -1.327 2.009E4 !bimolecular P => Int1 (Propan-2-on-1-yl + hydroxyl => Prop-1-en-2-peroxol) 1.346E-11 -0.2775 -278.5 P => Int2 (Propan-2-on-1-yl + hydroxyl => 1-Hydroxypropan-2-one) 0.1976 -3.588 750.9