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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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169141 75067887 1 ClFN2O2C24H24 ABC2D2E24F24 -38.78 8.03 -9.23 -1.32 0
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169142 75067888 1 ClN2O2C24H27 AB2C2D24E27 -21.62 9.54 -9.06 -1.17 0
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169143 75067889 1 ClN2O2C27H41 AB2C2D27E41 -139.59 4.35 -9.04 0.32 0
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169144 75067890 1 ClN2O3C25H29 AB2C3D25E29 -70.02 7.0 -9.04 -1.79 0
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169145 75067891 1 SN2O6C24H24 AB2C6D24E24 -147.49 7.84 -8.68 -0.77 0
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169146 75067892 1 O3N4C20H26 A3B4C20D26 -62.31 5.55 -8.28 -0.62 0
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169147 75067893 1 NO5C21H25 AB5C21D25 -135.85 1.32 -8.7 -0.08 0
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169148 75067894 2 NO2H10C11 AB2C10D11 -56.73 6.01 -8.36 -0.7 0
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169149 75068004 1 N3C19H21 A3B19C21 75.0 2.42 -9.01 -0.74 0
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169150 75068300 1 BrO2N3C31H40 AB2C3D31E40 -49.58 11.52 -7.85 -0.08 1
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169151 75068301 1 O2N3C31H40 A2B3C31D40 -11.4 3.26 0.0 0.0 0
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169152 75068302 1 BrN3O3C31H38 AB3C3D31E38 -63.53 5.76 -8.2 -0.25 1
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169153 75068303 1 N3O3C31H38 A3B3C31D38 -38.66 4.68 0.0 0.0 0
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169154 75068304 1 ClN3O3C31H38 AB3C3D31E38 -52.55 5.08 -8.24 -0.36 1
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169155 75068305 1 N3O3C31H38 A3B3C31D38 -8.61 7.33 0.0 0.0 0
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169156 75068341 1 OF4N5H25C26 AB4C5D25E26 -71.01 4.82 -8.98 -0.61 0
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169157 75068622 1 O4C29H50 A4B29C50 -219.5 4.9 -9.2 1.39 0
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169158 75068623 1 SN3O3C22H27 AB3C3D22E27 -57.41 6.86 -9.03 -0.28 0
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169159 75068657 1 Si2O5C40H62 A2B5C40D62 -281.0 4.51 -8.82 0.11 0
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169160 75068667 1 NO3H13C15 AB3C13D15 -65.71 14.03 -9.12 -1.44 0
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169161 75068831 2 NO16C25H40 AB16C25D40 -1420.18 5.02 -9.79 -0.35 0
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169162 75068832 2 NO16C24H37 AB16C24D37 -1390.45 6.16 -9.87 -0.52 0
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169163 75068859 1 N2O47H136C148 A2B47C136D148 -1545.55 8.65 -9.44 -0.99 0
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169164 75068860 2 NO24H66C73 AB24C66D73 -1485.31 20.42 -5.98 -2.78 0
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169165 75069383 1 O7C27H40 A7B27C40 -240.54 2.11 -8.39 -0.94 0