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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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30173 840430 1 OSN3H15C16 ABC3D15E16 46.66 4.37 -8.59 -0.68 0
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30174 840437 2 ON2H4C6 AB2C4D6 60.06 9.15 -9.96 -1.67 0
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30175 840446 1 SN2O2C16H18 AB2C2D16E18 -18.95 5.34 -8.96 -0.52 0
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30176 840447 1 ClOSN2C10H11 ABCD2E10F11 -20.35 2.88 -8.94 -0.93 0
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30177 840451 1 N4O4C15H20 A4B4C15D20 -62.2 1.31 -9.43 -1.17 0
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30178 840452 1 ClN2O4H13C15 AB2C4D13E15 -88.07 7.28 -8.51 -1.03 0
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30179 840457 2 NC6H9 AB6C9 -0.05 3.24 -8.38 0.57 0
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30180 840491 1 ClSN2O2C16H17 ABC2D2E16F17 -29.12 5.67 -8.78 -0.93 1
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30181 840505 1 INOC6H7 ABCD6E7 3.2 6.93 0.0 0.0 0
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30182 840511 1 ON3C19H23 AB3C19D23 43.98 2.1 -8.1 0.01 0
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30183 840514 1 N3O3H15C20 A3B3C15D20 16.76 3.7 -9.25 -0.77 0
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30184 840526 1 Cl3N3O3H8C11 A3B3C3D8E11 -73.03 2.36 -10.15 -1.19 0
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30185 840529 1 N2O5C18H20 A2B5C18D20 -110.05 1.28 -8.37 -0.36 0
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30186 840530 1 ON4C5H6 AB4C5D6 -1.53 1.91 -9.75 -0.89 0
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30187 840531 1 OSN2C19H20 ABC2D19E20 11.67 6.22 -8.87 -0.76 0
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30188 840532 1 ON2C19H20 AB2C19D20 30.01 3.21 -9.09 -0.5 0
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30189 840536 1 OSN2C9H12 ABC2D9E12 18.16 0.7 -8.53 -0.51 0
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30190 840549 1 ON2C12H18 AB2C12D18 11.32 3.54 -9.18 0.34 0
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30191 840558 1 N2O2C9H14 A2B2C9D14 -54.99 2.23 -9.51 0.31 0
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30192 840561 1 N2O2C19H22 A2B2C19D22 -72.58 1.52 -8.89 0.01 0
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30193 840563 1 BrOC12H13 ABC12D13 13.65 1.74 -9.59 -0.28 0
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30194 840564 1 Cl2N2O3H10C14 A2B2C3D10E14 -58.56 6.06 -8.7 -1.34 0
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30195 840575 1 SO3N4C16H18 AB3C4D16E18 24.67 9.99 -8.91 -1.74 0
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30196 840636 2 NO2C6H8 AB2C6D8 -107.69 5.77 -8.04 -0.44 1
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30197 840639 1 NOSC11H14 ABCD11E14 -32.98 4.28 0.0 0.0 0
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30198 840650 1 N2O3H18C20 A2B3C18D20 -10.5 5.19 -8.39 -0.86 0
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30199 840665 1 OCl2N2C16H18 AB2C2D16E18 -12.43 4.58 -9.24 -1.02 0
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30200 840676 1 O4N5H9C11 A4B5C9D11 66.35 5.51 -9.92 -1.84 0
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30201 840693 1 O2N3C16H19 A2B3C16D19 -14.33 3.85 -8.31 -0.66 0
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30202 840694 1 NO2C12H19 AB2C12D19 -72.68 2.65 -8.21 0.32 0
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30203 840703 1 ClON2C16H21 ABC2D16E21 -32.98 1.46 -9.09 -0.54 1
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30204 840704 1 NS2C12H12 AB2C12D12 39.51 6.01 0.0 0.0 0
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30205 840710 2 NOC8H10 ABC8D10 -33.05 6.0 -9.01 -0.16 0
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30206 840711 1 N2O4C19H22 A2B4C19D22 -83.85 4.77 -8.34 -0.26 0
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30207 840714 1 N2O3C19H20 A2B3C19D20 -28.02 3.54 -8.74 -0.5 0
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30208 840741 1 ClNSO2H6C9 ABCD2E6F9 -10.54 1.83 -9.77 -1.92 0
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30209 840743 1 N3O4C12H13 A3B4C12D13 -66.43 1.99 -9.12 -1.1 0
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30210 840744 1 ClSO2N3C16H16 ABC2D3E16F16 -61.17 4.35 -9.15 -0.72 0
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30211 840746 1 O2N3C10H11 A2B3C10D11 -7.78 5.28 -9.47 -1.14 0
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30212 840748 2 ClNOH6C7 ABCD6E7 -28.51 2.7 -9.13 -0.64 0
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30213 840758 1 NO4C16H19 AB4C16D19 -114.43 5.99 -8.65 -0.65 0
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30214 840764 1 N3O6H13C16 A3B6C13D16 -85.32 5.08 -9.34 -1.57 0
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30215 840769 1 ClFN2O4H10C14 ABC2D4E10F14 -89.58 10.11 -9.48 -1.46 0
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30216 840791 1 O4C15H18 A4B15C18 -144.18 4.63 -8.91 -0.66 0
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30217 840792 1 O4C15H18 A4B15C18 -144.6 3.85 -8.82 -0.71 0
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30218 840799 2 ClNOH6C7 ABCD6E7 -29.38 3.6 -9.27 -0.7 0
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30219 840800 1 N3O4C18H21 A3B4C18D21 -101.88 1.11 -8.05 -0.77 0
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30220 840803 1 O2N4C15H18 A2B4C15D18 18.08 4.43 -9.13 -0.83 0
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30221 840804 1 O2N3C11H11 A2B3C11D11 -35.4 2.61 -9.21 -0.8 0
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30222 840816 1 N3O3C19H23 A3B3C19D23 -60.15 3.07 -7.96 -0.5 0