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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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72152 48415868 1 N3O3C20H23 A3B3C20D23 -49.51 8.44 -8.53 -0.29 0
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72153 48415869 1 N3O3C20H23 A3B3C20D23 -61.28 6.94 -8.88 -0.09 0
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72154 48415870 1 N3O3C20H23 A3B3C20D23 -60.27 3.33 -8.82 -0.14 0
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72155 48415871 1 ON4C20H24 AB4C20D24 16.83 7.5 -8.57 -0.15 0
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72156 48415872 1 BrON3C18H18 ABC3D18E18 22.77 5.43 -9.07 -0.51 0
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72157 48415873 1 ClON3C18H18 ABC3D18E18 13.9 1.7 -8.97 -0.48 0
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72158 48415874 1 ON4C17H18 AB4C17D18 30.04 8.59 -8.54 -0.89 0
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72159 48415875 1 ON3C23H23 AB3C23D23 28.59 6.69 -8.61 -0.54 0
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72160 48415876 1 BrON3C18H18 ABC3D18E18 24.41 3.78 -9.09 -0.48 0
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72161 48415877 1 ON4C17H18 AB4C17D18 29.39 3.15 -8.98 -0.54 0
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72162 48415878 1 ON4C22H24 AB4C22D24 25.03 4.33 -8.39 -0.08 0
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72163 48415879 1 SO3N4C21H26 AB3C4D21E26 -66.23 7.79 -8.91 -0.66 0
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72164 48415880 1 ON5C23H25 AB5C23D25 50.8 2.32 -8.86 -0.66 0
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72165 48415881 1 O2N3C21H25 A2B3C21D25 -29.41 5.57 -8.76 -0.3 0
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72166 48415882 1 OSN4H18C19 ABC4D18E19 51.44 3.73 -9.02 -1.02 0
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72167 48415883 2 ON2C12H15 AB2C12D15 -50.39 4.13 -8.9 -0.35 0
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72168 48415884 1 FON3C18H18 ABC3D18E18 -30.3 5.97 -8.67 -0.63 0
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72169 48415885 1 ClON3C18H18 ABC3D18E18 12.25 5.23 -9.17 -0.5 0
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72170 48415886 1 O2N3C18H19 A2B3C18D19 -27.53 7.65 -8.54 -0.59 0
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72171 48415887 1 N4O4C19H20 A4B4C19D20 -20.38 7.9 -8.71 -1.73 0
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72172 48415888 1 O3N4C22H22 A3B4C22D22 -58.07 9.16 -8.59 -1.59 0
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72173 48415889 2 ON2C10H12 AB2C10D12 -45.23 7.45 -8.64 -0.25 0
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72174 48415890 1 FO2N4C23H27 AB2C4D23E27 -86.93 3.14 -9.05 -0.59 0
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72175 48415891 1 ON4C17H18 AB4C17D18 30.38 2.66 -9.13 -0.56 0
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72176 48415892 1 SO2N3C19H21 AB2C3D19E21 -17.71 4.03 -9.08 -1.01 0