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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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35150 7979389 1 SN2O4C22H22 AB2C4D22E22 -112.17 2.68 -8.97 -0.14 0
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35151 7979390 1 S2N3O4C18H23 A2B3C4D18E23 -111.92 6.66 -9.49 -1.03 0
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35152 7979391 1 FNSO4H18C21 ABCD4E18F21 -150.72 4.28 -9.34 -1.04 0
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35153 7979392 1 SCl2N2O2H10C14 AB2C2D2E10F14 -5.08 3.15 -9.58 -1.22 0
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35154 7979393 1 FNSO4H18C21 ABCD4E18F21 -153.05 3.88 -9.16 -0.81 0
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35155 7979394 1 ClS2N3O3C17H18 AB2C3D3E17F18 -64.01 2.57 -8.67 -0.98 0
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35156 7979395 1 FNSO4H18C21 ABCD4E18F21 -154.26 0.34 -9.14 -0.82 0
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35157 7979397 1 SN2O5C19H22 AB2C5D19E22 -178.99 1.34 -8.98 -0.17 1
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35158 7979399 1 NO3C15H24 AB3C15D24 -75.0 3.5 0.0 0.0 0
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35159 7979401 1 S2N3O4C18H21 A2B3C4D18E21 -91.68 1.62 -8.73 -0.75 0
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35160 7979402 1 SN2O5C19H22 AB2C5D19E22 -180.57 4.35 -9.02 -0.2 0
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35161 7979403 1 SN2O5C19H22 AB2C5D19E22 -178.97 1.21 -8.99 -0.19 0
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35162 7979404 1 SN3O4C18H19 AB3C4D18E19 -94.05 3.5 -8.33 -0.93 2
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35163 7979406 1 ClN2O4C22H31 AB2C4D22E31 -105.31 8.11 -8.8 -0.04 0
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35164 7979407 1 ClN2O4C22H29 AB2C4D22E29 -119.16 4.32 -8.43 0.02 0
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35165 7979408 1 SO2N3H9C13 AB2C3D9E13 32.59 4.02 -9.33 -1.25 0
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35166 7979409 1 SN2O4C22H28 AB2C4D22E28 -164.56 4.91 -9.07 -0.23 2
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35167 7979410 2 NO2C11H16 AB2C11D16 -92.57 2.0 -8.22 0.32 0
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35168 7979411 2 NO2C11H15 AB2C11D15 -106.5 2.54 -8.47 0.22 0
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35169 7979413 1 SN2O4C22H28 AB2C4D22E28 -164.77 4.38 -9.08 -0.25 0
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35170 7979418 1 SN2O4C21H26 AB2C4D21E26 -154.09 4.87 -9.04 -0.22 2
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35171 7979419 2 NO2C11H16 AB2C11D16 -98.51 4.94 -8.59 -0.06 0
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35172 7979422 1 N2O4C19H22 A2B4C19D22 -114.61 4.37 -8.54 -0.54 0
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35173 7979423 1 SN2O4C21H26 AB2C4D21E26 -152.39 3.71 -9.06 -0.26 0
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35174 7979424 1 N2O4C19H22 A2B4C19D22 -111.42 3.51 -8.96 -0.39 0