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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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140788 52760158 1 ClN3O3C22H28 AB3C3D22E28 -114.77 2.01 -9.34 -0.73 0
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140789 52760513 1 ClON4C21H29 ABC4D21E29 -10.97 4.74 -8.67 -0.7 1
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140790 52760514 1 O2N3C16H28 A2B3C16D28 -43.07 3.83 0.0 0.0 0
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140791 52760515 1 O2N3C16H27 A2B3C16D27 -65.42 5.97 -8.78 -0.29 0
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140792 52760575 1 O2N3C17H29 A2B3C17D29 -71.83 5.98 -8.79 -0.28 0
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140793 52761154 1 N2O5C25H34 A2B5C25D34 -202.44 3.87 -8.92 -0.38 0
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140794 52761246 1 SN3O5C21H31 AB3C5D21E31 -230.19 8.07 -8.85 -0.26 0
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140795 52761651 1 NO3C16H21 AB3C16D21 -125.47 4.39 -8.7 -0.44 0
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140796 52761655 1 O3N4C17H24 A3B4C17D24 -90.91 1.34 -8.89 -0.25 0
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140797 52762024 1 N2O4C25H30 A2B4C25D30 -134.56 5.09 -8.94 -0.41 0
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140798 52762187 1 NSO2C18H21 ABC2D18E21 -44.52 3.77 -8.55 0.11 0
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140799 52762838 1 N3O5C20H29 A3B5C20D29 -143.26 5.23 -8.96 -1.38 1
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140800 52764038 1 N2O2F4C19H21 A2B2C4D19E21 -225.5 5.64 0.0 0.0 0
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140801 52764039 1 N2O2F4C19H20 A2B2C4D19E20 -240.7 4.56 -8.99 -1.02 0
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140802 52764164 1 SN2O3C24H24 AB2C3D24E24 -54.07 4.52 -8.78 -0.4 0
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140803 52764177 1 ClO2N4C23H25 AB2C4D23E25 -27.99 4.84 -9.02 -0.51 0
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140804 52764178 2 ON2C12H14 AB2C12D14 -31.04 7.64 -8.96 -0.64 0
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140805 52764364 1 NO5C24H29 AB5C24D29 -154.79 4.83 -8.99 -0.5 0
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140806 52764365 1 N2O5C24H36 A2B5C24D36 -235.87 5.24 -8.81 0.21 0
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140807 52764366 1 N2O5C24H36 A2B5C24D36 -233.1 3.23 -8.95 0.11 0
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140808 52765326 1 BrNO4C19H20 ABC4D19E20 -130.28 3.72 -9.32 -0.41 0
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140809 52765408 1 N3O5C23H25 A3B5C23D25 -116.99 3.94 -9.05 -0.7 0
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140810 52765439 1 NO4C22H27 AB4C22D27 -156.57 4.47 -8.68 -0.15 0
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140811 52765471 1 N2O4C21H22 A2B4C21D22 -92.86 1.63 -9.07 -0.45 2
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140812 52765698 1 O3N5C25H37 A3B5C25D37 -41.46 6.61 -6.48 -0.61 1