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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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280175 103847351 1 SO3C15H20 AB3C15D20 -115.22 3.6 -8.88 -0.46 0
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280176 103847352 1 ClNOSC11H14 ABCDE11F14 -29.44 3.8 -9.13 -0.77 0
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280177 103847353 1 ClOSN2C11H17 ABCD2E11F17 -29.54 2.84 -8.72 0.1 0
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280178 103847359 1 SO3C10H18 AB3C10D18 -153.0 3.45 -8.88 0.38 0
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280179 103847367 1 BrNOSC11H14 ABCDE11F14 -19.6 2.5 -9.05 -0.72 0
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280180 103847374 1 SO3C16H22 AB3C16D22 -123.47 4.82 -8.53 -0.47 0
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280181 103847375 1 SO2C7H14 AB2C7D14 -105.0 1.66 -9.07 0.26 0
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280182 103847380 1 BrFOSC12H14 ABCDE12F14 -76.81 2.79 -9.0 -0.71 0
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280183 103847381 1 NSO2C12H17 ABC2D12E17 -65.57 7.66 -8.52 0.12 0
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280184 103847387 1 BrSO2C13H17 ABC2D13E17 -68.8 1.74 -9.13 -0.25 0
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280185 103847388 1 FSO3C14H17 ABC3D14E17 -163.21 3.67 -9.14 -0.98 0
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280186 103847395 1 BrSO2C13H17 ABC2D13E17 -68.82 3.94 -8.8 -0.2 0
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280187 103847397 1 BrOSC12H15 ABCD12E15 -30.86 2.31 -8.98 -0.42 0
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280188 103847426 1 S3N4O4C10H12 A3B4C4D10E12 -98.11 2.96 -8.85 -1.4 0
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280189 103847440 1 ClN2S2O4H9C11 AB2C2D4E9F11 -116.23 7.87 -9.64 -1.77 0
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280190 103847450 2 NSO2C6H6 ABC2D6E6 -110.29 8.42 -9.9 -1.49 0
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280191 103847460 1 N2S2O5C12H12 A2B2C5D12E12 -143.61 5.92 -8.96 -1.52 0
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280192 103847470 1 BrClN2O2S2H8C10 ABC2D2E2F8G10 -21.65 3.85 -9.59 -1.44 0
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280193 103847476 1 BrClN2O2S2H8C10 ABC2D2E2F8G10 -32.42 5.21 -9.05 -1.51 0
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280194 103847482 1 BrN2S2O4H9C11 AB2C2D4E9F11 -97.37 1.17 -10.05 -1.59 0
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280195 103847491 1 FSN2O4C11H15 ABC2D4E11F15 -197.99 9.45 -9.62 -0.89 0
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280196 103847496 1 FNSO4C11H14 ABCD4E11F14 -208.71 8.59 -9.74 -0.81 0
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280197 103847498 1 FSN3O4H8C10 ABC3D4E8F10 -149.15 3.34 -9.85 -0.99 0
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280198 103847515 1 FNSO4C12H16 ABCD4E12F16 -212.48 8.64 -9.75 -0.81 0
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280199 103847517 1 NSF2O4H9C13 ABC2D4E9F13 -206.31 8.39 -9.67 -1.45 0