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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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214320 84975079 1 ClN2O3C20H21 AB2C3D20E21 -62.95 3.4 -8.19 -0.71 1
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214321 84975080 1 ON2C19H23 AB2C19D23 3.54 5.12 0.0 0.0 0
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214322 84975081 1 ON2C19H22 AB2C19D22 -6.21 2.79 -9.02 -0.1 0
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214323 84975087 1 ClO2N3C16H22 AB2C3D16E22 -94.58 4.3 -9.34 -0.23 1
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214324 84975092 1 ClO2N3C16H23 AB2C3D16E23 -72.39 3.07 0.0 0.0 0
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214325 84975117 1 O2N3C18H27 A2B3C18D27 -102.51 1.36 -9.04 0.34 0
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214326 84975119 1 Cl2O3N4C17H22 A2B3C4D17E22 -128.64 4.18 -9.36 -0.56 1
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214327 84975121 1 O2N3C20H30 A2B3C20D30 -65.84 2.56 0.0 0.0 0
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214328 84975128 1 FN2O2C19H21 AB2C2D19E21 -66.34 7.8 -8.19 -0.66 0
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214329 84975151 1 O2N3C16H23 A2B3C16D23 -84.48 5.01 -8.92 0.18 1
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214330 84975168 1 SN3O3C23H32 AB3C3D23E32 -71.7 8.26 0.0 0.0 0
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214331 84975170 1 ClN2O3C21H23 AB2C3D21E23 -66.89 1.52 -8.2 -0.7 0
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214332 84975174 3 NOC5H7 ABC5D7 -117.51 1.95 -8.71 0.06 0
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214333 84975176 1 ClN3O5C18H22 AB3C5D18E22 -224.0 6.47 -9.23 -1.19 1
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214334 84975188 1 O2N3C18H28 A2B3C18D28 -78.42 4.14 0.0 0.0 0
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214335 84975189 1 O2N3C18H27 A2B3C18D27 -99.14 2.49 -8.54 0.21 0
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214336 84975203 1 N3O3C20H23 A3B3C20D23 -78.82 2.33 -8.95 -0.32 0
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214337 84975204 1 SF2N4O4C16H20 AB2C4D4E16F20 -258.56 8.12 -9.34 -0.8 1
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214338 84975208 1 BrO2N3C15H21 AB2C3D15E21 -64.15 5.59 0.0 0.0 0
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214339 84975212 1 SN2O3C19H22 AB2C3D19E22 -73.07 2.11 -8.86 -0.97 1
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214340 84975217 1 N3O3C15H22 A3B3C15D22 -93.42 2.68 0.0 0.0 1
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214341 84975219 1 ClO2N3C15H21 AB2C3D15E21 -64.26 4.43 0.0 0.0 0
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214342 84975220 1 ClO2N3C15H20 AB2C3D15E20 -83.96 6.13 -9.33 -0.52 0
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214343 84975221 1 SCl2N2O3C18H18 AB2C2D3E18F18 -75.79 6.71 -9.6 -1.11 1
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214344 84975227 1 N3O3C17H26 A3B3C17D26 -102.32 5.52 0.0 0.0 0