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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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239126 93166022 1 FOS2N3C24H28 ABC2D3E24F28 -22.32 5.98 -8.49 -0.49 0
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239127 93166023 1 OS2N3C20H29 AB2C3D20E29 -12.16 7.22 -8.09 -0.9 0
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239128 93166026 1 N2S2O3C24H30 A2B2C3D24E30 -75.12 6.79 -9.04 -0.78 0
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239129 93166029 1 ClN2S2O3C22H25 AB2C2D3E22F25 -66.85 5.1 -9.22 -0.78 0
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239130 93166030 1 ClN2S2O3C22H25 AB2C2D3E22F25 -70.4 6.86 -8.98 -0.51 0
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239131 93166033 1 N2S2O5C23H28 A2B2C5D23E28 -124.59 7.15 -8.79 -0.5 0
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239132 93166034 1 N2S2O5C23H28 A2B2C5D23E28 -125.55 4.75 -8.91 -0.52 0
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239133 93166036 1 N2S2O3C23H28 A2B2C3D23E28 -70.69 4.51 -8.94 -0.4 0
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239134 93166037 1 N2S2O4C23H28 A2B2C4D23E28 -100.57 6.76 -9.04 -0.47 0
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239135 93166038 1 N2S2O4C23H28 A2B2C4D23E28 -102.71 4.5 -8.92 -0.38 0
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239136 93166039 1 ClN2S2O3C22H25 AB2C2D3E22F25 -69.39 6.97 -9.29 -0.66 0
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239137 93166040 1 ClN2S2O3C22H25 AB2C2D3E22F25 -66.75 5.56 -9.24 -0.46 0
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239138 93166041 1 ClN2S2O4C22H25 AB2C2D4E22F25 -102.36 5.62 -9.34 -0.76 0
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239139 93166042 1 ClN2S2O4C22H25 AB2C2D4E22F25 -99.62 4.94 -9.41 -0.67 0
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239140 93166044 1 N2S2O3C24H30 A2B2C3D24E30 -76.92 4.47 -8.76 -0.41 0
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239141 93166045 2 NSO2C11H13 ABC2D11E13 -91.84 5.72 -9.11 -0.68 0
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239142 93166046 2 NSO2C11H13 ABC2D11E13 -91.88 5.19 -8.99 -0.39 0
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239143 93166049 1 N2S2O5C24H30 A2B2C5D24E30 -132.26 6.84 -8.93 -0.46 0
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239144 93166051 1 FNOC15H22 ABCD15E22 -74.05 2.38 -9.0 -0.07 0
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239145 93166052 1 FNOC15H22 ABCD15E22 -73.66 2.11 -8.67 -0.06 0
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239146 93166053 1 FNO2C17H24 ABC2D17E24 -111.31 6.51 -8.91 0.21 0
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239147 93166054 1 FNO2C17H24 ABC2D17E24 -112.2 2.27 -9.07 -0.14 0
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239148 93166056 1 NO3C18H29 AB3C18D29 -106.4 1.33 -8.19 0.29 0
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239149 93166057 1 NO4C17H27 AB4C17D27 -129.91 3.0 -8.32 0.22 0
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239150 93166058 1 NO4C17H27 AB4C17D27 -129.26 3.4 -8.12 0.44 0