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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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137212 52170731 1 SN2O4C17H24 AB2C4D17E24 -153.49 2.76 -9.43 -0.53 0
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137213 52171158 1 ON6C18H20 AB6C18D20 59.18 4.48 -8.47 -0.89 0
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137214 52171159 1 SO3N4C20H20 AB3C4D20E20 -36.18 5.61 -8.55 -0.5 0
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137215 52171695 1 SN2O2C15H24 AB2C2D15E24 -76.17 4.15 -8.75 -0.45 0
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137216 52172029 1 NOC15H21 ABC15D21 -54.77 3.65 -9.32 0.19 0
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137217 52172203 1 O2N4C21H22 A2B4C21D22 -24.69 6.37 -8.86 -0.56 0
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137218 52172770 1 O2N3C23H33 A2B3C23D33 -68.31 2.66 -8.99 0.2 0
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137219 52172771 2 ON2C9H12 AB2C9D12 46.76 6.15 -9.33 -0.72 0
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137220 52172795 1 FNO5H12C15 ABC5D12E15 -108.65 4.69 -9.44 -1.58 0
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137221 52172817 1 FN3O6H14C15 AB3C6D14E15 -99.67 8.54 -9.54 -1.83 0
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137222 52172818 1 FN3O6H14C15 AB3C6D14E15 -97.67 5.16 -9.74 -1.65 0
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137223 52172819 1 FN3O6H14C15 AB3C6D14E15 -96.85 7.84 -9.41 -1.64 0
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137224 52172820 1 FN3O6H14C15 AB3C6D14E15 -101.46 5.1 -9.75 -1.75 1
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137225 52172821 1 FO2N3C15H23 AB2C3D15E23 -35.81 27.46 0.0 0.0 0
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137226 52172822 1 FO2N3C15H22 AB2C3D15E22 -68.36 8.75 -9.06 -1.12 0
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137227 52172904 1 N3O3C19H23 A3B3C19D23 -101.82 5.38 -8.87 -0.4 0
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137228 52173036 1 FON3C20H22 ABC3D20E22 -18.51 6.08 -8.74 -0.43 0
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137229 52173226 1 SO2N4C18H18 AB2C4D18E18 75.01 6.69 -8.89 -1.33 1
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137230 52173365 1 O2N3C25H30 A2B3C25D30 -19.79 2.76 0.0 0.0 0
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137231 52173366 1 O2N3C25H29 A2B3C25D29 -32.06 2.04 -8.74 -0.68 1
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137232 52173367 1 O3N4C22H29 A3B4C22D29 -18.77 4.4 0.0 0.0 0
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137233 52174302 1 ClN2F3O4H12C16 AB2C3D4E12F16 -209.4 5.44 -9.68 -1.55 0
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137234 52175199 1 BrNOC12H16 ABCD12E16 -22.21 2.0 -8.86 -0.18 1
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137235 52175381 1 IN2O2C15H18 AB2C2D15E18 -0.63 7.49 0.0 0.0 0
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137236 52175457 1 BrN2S2O3C10H13 AB2C2D3E10F13 -88.33 5.72 -9.52 -1.13 0