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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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166017 74626519 1 N3O7C23H25 A3B7C23D25 -252.03 8.03 -9.05 -0.3 1
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166018 74627167 1 SN2O3C18H25 AB2C3D18E25 -63.48 4.76 0.0 0.0 0
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166019 74627168 1 SN2O3C18H24 AB2C3D18E24 -77.59 7.5 -8.68 0.08 1
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166020 74627169 1 OCl2N2S2C13H15 AB2C2D2E13F15 21.67 6.13 0.0 0.0 1
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166021 74627175 1 SO2N4C19H23 AB2C4D19E23 2.05 2.13 0.0 0.0 1
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166022 74627203 1 OS2N4C18H21 AB2C4D18E21 50.72 8.23 0.0 0.0 1
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166023 74627233 1 OSN3C18H20 ABC3D18E20 67.63 17.77 0.0 0.0 1
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166024 74627261 1 SN2O2C17H21 AB2C2D17E21 -9.04 1.24 0.0 0.0 1
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166025 74627466 1 N2O3C21H25 A2B3C21D25 -56.36 5.79 0.0 0.0 1
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166026 74627497 1 N2O3C22H29 A2B3C22D29 -52.8 3.05 0.0 0.0 1
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166027 74627547 1 OSN3C18H22 ABC3D18E22 55.02 4.55 0.0 0.0 0
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166028 74627626 1 N3O4C25H37 A3B4C25D37 -147.4 2.18 -8.32 -0.27 0
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166029 74627739 1 NSO4C23H27 ABC4D23E27 -99.36 11.35 -8.9 -0.64 1
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166030 74627809 1 BrFOS2N3H16C21 ABCD2E3F16G21 59.56 5.61 0.0 0.0 1
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166031 74628034 1 N2O5C22H27 A2B5C22D27 -140.53 8.07 0.0 0.0 0
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166032 74628055 1 O2N3C16H23 A2B3C16D23 -71.47 2.32 -8.9 0.39 0
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166033 74628332 1 N2O4C23H38 A2B4C23D38 -202.44 1.33 -8.21 0.27 0
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166034 74628610 1 SN3O3H19C24 AB3C3D19E24 -3.04 6.75 -8.75 -1.32 1
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166035 74628611 1 N2O6C24H29 A2B6C24D29 -238.09 4.39 0.0 0.0 0
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166036 74628612 2 NO3C12H14 AB3C12D14 -230.89 1.02 -8.66 -0.25 0
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166037 74629240 1 S2N3O4C16H19 A2B3C4D16E19 -83.72 6.5 -9.52 -2.29 0
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166038 74629241 1 O4N5C23H25 A4B5C23D25 -41.35 6.34 -9.36 -1.17 1
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166039 74629242 1 BrFON2C19H21 ABCD2E19F21 -35.89 6.01 0.0 0.0 1
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166040 74629243 1 OF3N3C19H21 AB3C3D19E21 -137.55 5.45 0.0 0.0 0
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166041 74629396 1 N2F3O5H11C14 A2B3C5D11E14 -328.49 7.02 -9.64 -1.72 0