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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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149177 53788849 1 O2C19H28 A2B19C28 -120.78 3.87 -9.78 0.03 0
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149178 53788850 1 O2C19H28 A2B19C28 -120.82 3.89 -9.78 0.03 0
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149179 53788851 1 O2C19H28 A2B19C28 -120.81 3.88 -9.78 0.02 0
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149180 53788852 1 ON4C21H24 AB4C21D24 35.41 5.44 -8.62 -0.68 0
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149181 53788853 1 NSO3C11H17 ABC3D11E17 -132.05 6.23 -9.25 0.1 0
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149182 53788854 1 SO4N7C29H37 AB4C7D29E37 -48.19 9.02 -8.26 -0.55 0
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149183 53788855 1 NF2O2H9C14 AB2C2D9E14 -90.56 2.68 -9.56 -0.81 0
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149184 53788856 1 N2O2C27H42 A2B2C27D42 -86.6 4.22 -8.62 0.37 0
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149185 53788857 1 IN4C9H9 AB4C9D9 93.56 1.64 -8.6 -0.81 0
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149186 53788858 1 N2O7C23H30 A2B7C23D30 -306.92 10.34 -10.12 -0.68 0
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149187 53788859 1 ClOSi2C17H27 ABC2D17E27 -144.31 3.31 -8.21 0.13 0
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149188 53788860 1 S2O4N5C16H21 A2B4C5D16E21 -19.78 4.65 -8.82 -0.7 0
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149189 53788861 1 IO3C12H23 AB3C12D23 -168.45 1.23 -10.12 -1.18 0
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149190 53788862 1 IO3C12H23 AB3C12D23 -171.74 2.09 -10.14 -1.19 0
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149191 53788863 1 BrSN2O4C25H31 ABC2D4E25F31 -139.95 7.65 -9.09 -1.06 0
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149192 53788864 1 NPS2O3C6H14 ABC2D3E6F14 -186.15 3.98 -9.28 -0.24 0
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149193 53788865 1 NO4C16H19 AB4C16D19 -143.31 4.52 -9.28 0.2 0
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149194 53788866 1 SN3O5C20H27 AB3C5D20E27 -163.08 8.32 -9.4 -0.68 0
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149195 53788867 1 NO3C21H25 AB3C21D25 -92.77 5.64 -9.3 0.06 0
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149196 53788868 1 O2F4C23H32 A2B4C23D32 -306.77 5.06 -9.75 -0.72 0
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149197 53788869 1 SN2O5C9H16 AB2C5D9E16 -169.8 7.42 -9.88 -0.11 0
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149198 53788870 1 N2O5C11H12 A2B5C11D12 -123.34 4.63 -10.5 -1.85 0
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149199 53788871 1 N2O5C13H16 A2B5C13D16 -117.8 2.57 -9.1 -0.87 0
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149200 53788872 1 N2O4C25H28 A2B4C25D28 -119.82 4.05 -8.59 -0.42 0
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149201 53788873 1 N5H21C22 A5B21C22 121.16 7.98 -8.73 -0.92 0