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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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89123 49959515 1 BrClN2O3H18C19 ABC2D3E18F19 -33.11 3.32 -9.0 -0.79 0
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89124 49959524 1 N4O6H10C15 A4B6C10D15 21.66 4.86 -10.26 -2.08 0
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89125 49959527 1 Br2N3O5H13C17 A2B3C5D13E17 -8.29 9.37 -9.82 -1.36 0
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89126 49959530 1 N3O5C20H21 A3B5C20D21 -37.53 5.45 -8.99 -1.42 0
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89127 49959531 1 BrN3O5H14C17 AB3C5D14E17 -20.52 6.99 -9.27 -1.44 0
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89128 49959532 1 N3O5H17C18 A3B5C17D18 -27.32 7.7 -8.94 -1.38 0
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89129 49959543 1 BrClN3O5H11C16 ABC3D5E11F16 -13.63 4.92 -9.54 -1.45 0
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89130 49959549 1 ClN2Br3O3H10C16 AB2C3D3E10F16 -1.89 1.38 -9.33 -1.15 0
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89131 49959551 1 N2Br3O3H15C18 A2B3C3D15E18 -2.78 6.94 -9.07 -1.15 0
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89132 49959552 2 BrNOH7C9 ABCD7E9 39.78 5.18 -9.28 -1.2 0
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89133 49959555 1 Br2N2O2C15H16 A2B2C2D15E16 -13.53 4.18 -9.39 -0.74 0
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89134 49959558 1 SBr2N2O2H10C15 AB2C2D2E10F15 55.67 3.46 -9.39 -1.42 0
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89135 49959561 1 N2O2Br3H11C16 A2B2C3D11E16 30.65 1.8 -9.43 -1.21 0
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89136 49959562 1 N2Br3O3H15C18 A2B3C3D15E18 -7.97 1.66 -9.34 -1.0 0
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89137 49959567 1 N2Br3O3H13C17 A2B3C3D13E17 -3.45 1.21 -9.22 -1.16 0
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89138 49959573 1 Br2N2O3H16C18 A2B2C3D16E18 -13.03 4.23 -8.95 -0.99 0
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89139 49959596 1 Br2N2O3H16C18 A2B2C3D16E18 -30.46 4.38 -9.16 -1.04 0
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89140 49959597 1 BrN2O2H15C18 AB2C2D15E18 36.01 6.34 -9.21 -1.14 0
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89141 49959635 1 N2O3H8C11 A2B3C8D11 -5.9 4.81 -9.18 -1.11 0
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89142 49959643 1 N2O2C13H16 A2B2C13D16 -32.36 2.88 -9.26 -0.49 0
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89143 49959644 1 BrN2O3H11C14 AB2C3D11E14 -10.89 4.5 -9.26 -1.0 0
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89144 49959668 1 ClBr2N2O3H13C17 AB2C2D3E13F17 -10.39 6.0 -9.04 -1.09 0
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89145 49959669 1 BrClN2O2H14C18 ABC2D2E14F18 28.92 5.36 -8.98 -1.23 0
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89146 49959670 1 BrClN2O3H14C17 ABC2D3E14F17 -17.39 6.08 -9.13 -1.03 0
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89147 49959671 1 BrN2O2H17C21 AB2C2D17E21 34.74 6.29 -8.93 -0.73 0