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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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292650 117356381 1 ClNO2C12H16 ABC2D12E16 -79.23 2.0 -9.02 -0.31 0
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292651 117356384 1 ClNO2C12H16 ABC2D12E16 -73.27 4.65 -8.79 -0.12 0
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292652 117356395 1 ClNO2C12H16 ABC2D12E16 -80.43 2.92 -8.78 -0.33 0
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292653 117356442 1 ClNO2C12H16 ABC2D12E16 -76.94 2.86 -8.86 -0.23 0
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292654 117356443 1 ClNO2C12H16 ABC2D12E16 -82.51 2.49 -8.63 -0.08 0
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292655 117356480 1 ClNO2C12H16 ABC2D12E16 -76.95 5.87 -9.09 -0.48 0
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292656 117356486 1 ClNO2C12H16 ABC2D12E16 -72.94 3.17 -9.15 -0.49 0
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292657 117356488 1 ClNO2C12H16 ABC2D12E16 -95.13 6.43 -8.63 -0.12 0
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292658 117356489 1 ClNO2C12H16 ABC2D12E16 -87.14 1.85 -8.78 -0.17 0
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292659 117356495 1 ClNO2C12H16 ABC2D12E16 -78.97 0.66 -8.6 -0.48 0
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292660 117356507 1 ClNO2C12H16 ABC2D12E16 -72.35 1.88 -9.13 -0.21 0
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292661 117356539 1 ClNO2C12H16 ABC2D12E16 -70.88 1.48 -8.64 -0.33 0
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292662 117356594 1 ClFNC13H17 ABCD13E17 -58.22 1.14 -9.28 -0.35 0
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292663 117356623 1 ClFNC13H17 ABCD13E17 -51.92 3.16 -8.78 -0.16 0
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292664 117356635 1 ClFNC13H17 ABCD13E17 -55.01 1.13 -8.87 -0.19 0
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292665 117356644 1 ClFNC13H17 ABCD13E17 -58.55 4.2 -8.96 -0.26 0
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292666 117356659 1 ClFNC13H17 ABCD13E17 -61.78 2.34 -9.21 -0.18 0
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292667 117356668 1 ClNOC13H20 ABCD13E20 -56.21 1.46 -9.09 -0.03 0
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292668 117356718 1 ClNOC13H20 ABCD13E20 -54.7 3.23 -9.15 -0.16 0
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292669 117356735 1 ClNOC13H20 ABCD13E20 -64.86 4.05 -8.84 -0.06 0
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292670 117356741 1 ClNOC13H20 ABCD13E20 -56.05 2.19 -8.74 0.17 0
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292671 117356747 1 ClNOC13H20 ABCD13E20 -63.65 3.75 -8.81 -0.04 0
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292672 117356795 1 BrNO2H8C9 ABC2D8E9 -26.78 2.09 -9.01 -1.01 0
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292673 117356831 1 BrON3C8H8 ABC3D8E8 38.35 4.38 -8.46 -0.41 0
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292674 117356842 1 BrNOC10H12 ABCD10E12 -12.65 4.99 -9.01 -0.08 0
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292675 117356851 1 BrNOC10H12 ABCD10E12 -12.21 2.88 -9.02 -0.17 0
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292676 117356888 1 BrNC11H16 ABC11D16 -0.4 1.79 -9.35 0.03 0
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292677 117356903 1 BrNC11H16 ABC11D16 -7.65 3.47 -9.15 0.08 0
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292678 117356922 1 F2O4H8C11 A2B4C8D11 -213.72 2.2 -9.74 -1.12 0
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292679 117356927 1 F2N2O3H8C10 A2B2C3D8E10 -118.27 3.27 -9.31 -1.21 0
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292680 117356928 1 F2N2O3H8C10 A2B2C3D8E10 -115.15 8.78 -8.22 -1.44 0
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292681 117356973 1 FO5C11H11 AB5C11D11 -218.04 4.44 -9.43 -1.13 0
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292682 117356975 1 FO5C11H11 AB5C11D11 -223.15 4.18 -9.77 -1.26 0
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292683 117356991 1 FO5C11H11 AB5C11D11 -221.09 1.94 -9.32 -0.72 0
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292684 117356993 1 FO5C11H11 AB5C11D11 -221.33 2.8 -9.26 -0.75 0
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292685 117357006 1 FO5C11H11 AB5C11D11 -224.63 3.37 -9.17 -0.66 0
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292686 117357008 1 FO5C11H11 AB5C11D11 -232.27 2.34 -9.45 -0.8 0
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292687 117357061 1 FO5C11H11 AB5C11D11 -226.2 4.24 -8.78 -0.52 0
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292688 117357083 1 F2O3C12H12 A2B3C12D12 -188.95 5.49 -9.45 -0.55 0
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292689 117357091 1 F2O3C12H12 A2B3C12D12 -181.29 4.99 -9.39 -0.56 0
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292690 117357092 1 F2O3C12H12 A2B3C12D12 -205.1 5.64 -9.53 -0.84 0
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292691 117357097 1 F2O3C12H12 A2B3C12D12 -198.28 2.05 -10.18 -1.43 0
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292692 117357162 1 F2O3C12H12 A2B3C12D12 -186.42 3.69 -9.55 -0.72 0
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292693 117357195 1 N2O3H10C13 A2B3C10D13 -18.42 6.22 -8.37 -0.98 0
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292694 117357202 1 N2O3H10C13 A2B3C10D13 -13.01 6.41 -8.7 -1.26 0
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292695 117357205 1 N2O3H10C13 A2B3C10D13 -39.65 4.18 -9.01 -0.96 0
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292696 117357216 1 N2O3H10C13 A2B3C10D13 -16.18 4.74 -8.84 -1.18 0
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292697 117357221 2 ON2H5C6 AB2C5D6 21.0 1.65 -8.87 -0.99 0
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292698 117357223 2 ON2H5C6 AB2C5D6 -0.56 7.56 -8.93 -0.72 0
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292699 117357224 2 ON2H5C6 AB2C5D6 12.34 1.25 -9.04 -1.11 0