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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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158940 57244255 1 N2O2C11H26 A2B2C11D26 -111.19 1.69 -9.04 2.01 0
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158941 57244260 1 SN2O3H16C20 AB2C3D16E20 8.36 6.96 -8.91 -0.93 0
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158942 57244261 1 ON6C28H38 AB6C28D38 24.94 5.59 -8.71 -1.05 0
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158943 57244264 1 O9C28H50 A9B28C50 -435.22 3.76 -10.4 -0.75 0
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158944 57244265 1 FNPO6C27H27 ABCD6E27F27 -182.96 5.47 -9.46 -0.82 0
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158945 57244269 2 OSN2C12H12 ABC2D12E12 15.48 8.86 -8.72 -1.02 0
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158946 57244274 1 OSiN3C8H17 ABC3D8E17 -49.36 4.57 -9.6 0.2 0
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158947 57244276 1 BrNH16C17 ABC16D17 97.69 0.86 -9.47 -0.35 0
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158948 57244280 1 FN2O4C31H31 AB2C4D31E31 -78.63 2.42 -8.77 -0.92 0
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158949 57244282 1 NF3O3C4H4 AB3C3D4E4 -276.17 2.24 -11.02 -1.07 0
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158950 57244286 1 NSC17H27 ABC17D27 18.31 3.43 -8.51 -1.34 0
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158951 57244287 1 SiN2O5C24H40 AB2C5D24E40 -263.6 4.64 -9.09 -0.38 0
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158952 57244288 1 ClN3O3C28H40 AB3C3D28E40 -184.61 4.04 -8.63 -0.46 0
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158953 57244290 1 O2F3C9H11 A2B3C9D11 -226.37 4.9 -10.66 -0.14 0
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158954 57244291 1 N3O3C23H31 A3B3C23D31 -101.71 2.71 -8.1 0.21 0
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158955 57244293 1 ON3H9C11 AB3C9D11 40.99 7.91 -9.28 -1.08 0
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158956 57244294 2 SC4H9 AB4C9 -36.35 2.73 -8.93 0.53 0
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158957 57244297 1 N3O3H17C26 A3B3C17D26 10.57 8.03 -9.23 -1.74 0
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158958 57244298 1 NO2C8H15 AB2C8D15 -61.74 3.65 -9.53 0.22 0
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158959 57244299 1 ClNOPC11H11 ABCDE11F11 -28.3 2.88 -9.28 -1.11 1
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158960 57244301 1 NPO2C9H19 ABC2D9E19 -113.09 7.37 0.0 0.0 0
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158961 57244304 1 ClNSO5C18H18 ABCD5E18F18 -177.62 2.3 -9.66 -1.04 0
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158962 57244305 2 SO2H5C7 AB2C5D7 -78.57 4.32 -9.32 -1.63 0
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158963 57244306 1 N3O4C23H31 A3B4C23D31 -152.4 5.72 -9.2 -0.74 0
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158964 57244307 1 FN3O3C22H26 AB3C3D22E26 -135.74 4.74 -8.65 -0.48 0