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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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193264 78366585 1 SO2N3C18H27 AB2C3D18E27 -92.58 4.44 -8.91 0.08 0
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193265 78366586 1 ClOS2N4C20H25 ABC2D4E20F25 17.39 1.81 -8.76 -0.7 0
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193266 78366587 1 SO2N5C23H31 AB2C5D23E31 -22.9 4.26 -8.49 -0.13 0
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193267 78366588 1 SO2N5C23H33 AB2C5D23E33 -50.93 4.02 -8.73 -0.34 0
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193268 78366589 1 BrN2S2O3C18H21 AB2C2D3E18F21 -99.8 3.42 -8.9 -0.67 0
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193269 78366726 1 OSN4C20H28 ABC4D20E28 -6.49 1.87 -8.56 -0.05 0
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193270 78367111 1 Cl2N2S2O3H18C26 A2B2C2D3E18F26 35.19 4.38 -8.62 -1.66 0
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193271 78367504 1 Cl2O2F3N4H19C20 A2B2C3D4E19F20 -179.86 5.36 -8.28 -1.21 0
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193272 78367744 1 BrN2O2S2C22H23 AB2C2D2E22F23 -18.74 3.46 -8.71 -0.52 0
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193273 78367873 1 N4O5C15H18 A4B5C15D18 -191.85 9.12 -9.28 -0.84 1
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193274 78368151 1 O3N5C23H26 A3B5C23D26 -55.85 9.94 0.0 0.0 0
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193275 78368726 1 O2S2N6C19H26 A2B2C6D19E26 2.01 3.65 -8.49 -1.12 0
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193276 78369006 1 ClN2O3C11H11 AB2C3D11E11 -114.0 3.71 -9.34 -0.53 0
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193277 78369007 1 BrON3H16C17 ABC3D16E17 66.2 4.8 -9.0 -1.48 0
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193278 78369643 1 ClO2N5C17H18 AB2C5D17E18 -14.52 4.6 -8.53 -0.6 0
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193279 78369709 1 SN3O5C19H25 AB3C5D19E25 -201.2 3.93 -9.45 -0.57 1
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193280 78369710 1 ClO2N5C18H19 AB2C5D18E19 -8.71 4.51 0.0 0.0 0
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193281 78369711 1 S2N4O4H22C23 A2B4C4D22E23 -23.53 4.52 -8.83 -1.27 0
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193282 78369725 1 ON4H12C20 AB4C12D20 141.89 5.67 -8.65 -2.28 0
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193283 78370261 1 FN3O3H12C16 AB3C3D12E16 -91.53 7.23 -8.89 -1.89 0
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193284 78370262 1 N3O3C17H21 A3B3C17D21 -87.65 7.58 -9.31 -1.57 0
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193285 78370310 1 SO3N5C16H23 AB3C5D16E23 -56.86 2.46 -8.61 -0.61 1
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193286 78370311 1 ClO3N5C17H17 AB3C5D17E17 -27.08 6.43 0.0 0.0 0
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193287 78370408 1 ClFOSN7C20H21 ABCDE7F20G21 34.77 8.12 -8.75 -0.88 0
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193288 78370704 1 BrFSN6C18H18 ABCD6E18F18 91.58 6.55 -8.64 -0.68 0