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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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251250 103102456 2 ON2C7H9 AB2C7D9 -41.88 5.95 -9.41 -0.73 0
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251251 103102470 1 N3O3C14H19 A3B3C14D19 -82.89 4.31 -9.35 -0.73 0
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251252 103102476 1 ON4C11H14 AB4C11D14 17.11 8.29 -9.4 -0.81 0
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251253 103102478 2 ON2C7H9 AB2C7D9 -44.39 4.9 -9.51 -0.96 0
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251254 103102482 2 ON2C5H9 AB2C5D9 -69.7 2.44 -9.01 0.76 0
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251255 103102487 1 SN3O3C8H15 AB3C3D8E15 -111.29 4.55 -10.03 -0.66 0
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251256 103102500 1 SN3O3C13H17 AB3C3D13E17 -92.3 2.97 -8.6 -0.71 0
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251257 103102508 1 SO3N4C8H14 AB3C4D8E14 -118.39 1.61 -9.03 -0.85 0
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251258 103102513 1 SO2N4C11H14 AB2C4D11E14 -40.81 4.38 -9.2 -1.44 0
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251259 103102516 1 SO2N3C8H15 AB2C3D8E15 -92.6 2.36 -9.22 -0.75 0
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251260 103102521 1 S2N3O3C11H15 A2B3C3D11E15 -91.76 5.55 -8.96 -1.33 0
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251261 103102533 1 ClS2N3O3C11H14 AB2C3D3E11F14 -94.75 6.21 -9.16 -1.48 0
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251262 103102543 1 FOSN3C11H14 ABCD3E11F14 -64.24 3.89 -8.58 -0.83 0
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251263 103102544 1 OSN4C10H14 ABC4D10E14 -0.69 3.51 -8.99 -1.15 0
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251264 103102550 1 OSF3N3C12H14 ABC3D3E12F14 -175.08 4.81 -8.89 -0.98 0
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251265 103102555 1 OSN3C11H15 ABC3D11E15 -14.17 3.35 -8.51 -0.66 0
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251266 103102565 1 OSN4C13H18 ABC4D13E18 -16.01 6.23 -8.71 -1.03 0
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251267 103102620 1 BrClN2O2C11H12 ABC2D2E11F12 -71.94 0.26 -9.93 -1.04 0
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251268 103102628 1 BrO2N3C12H16 AB2C3D12E16 -43.58 3.89 -9.32 -0.42 0
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251269 103102642 1 BrClN2O2C11H12 ABC2D2E11F12 -68.5 2.18 -9.95 -1.08 0
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251270 103102645 1 BrClN2O2C11H12 ABC2D2E11F12 -68.29 2.16 -9.92 -0.9 0
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251271 103102658 1 BrN2O2C12H15 AB2C2D12E15 -74.35 1.56 -9.79 -0.59 0
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251272 103102668 1 O2N3C11H21 A2B3C11D21 -110.29 1.87 -8.99 0.64 0
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251273 103102669 1 O2N4C9H18 A2B4C9D18 -90.78 6.93 -8.72 0.4 0
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251274 103102682 1 ON3C8H19 AB3C8D19 -58.77 4.65 -9.12 1.14 0