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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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51183 12013818 1 N2O2C13H15 A2B2C13D15 12.02 6.77 0.0 0.0 0
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51184 12013819 1 O2C13H14 A2B13C14 -46.77 5.44 -9.58 0.18 0
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51185 12013820 2 OC4H6 AB4C6 -78.48 5.39 -10.79 0.58 0
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51186 12013821 2 OC6H6 AB6C6 -43.27 5.23 -9.86 -0.08 0
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51187 12013822 1 O2H14C17 A2B14C17 -9.02 5.03 -9.63 -0.16 0
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51188 12013823 1 O2H10C11 A2B10C11 -35.02 4.88 -9.72 0.05 0
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51189 12013824 2 NOC4H6 ABC4D6 -21.51 3.86 -10.03 -0.9 1
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51190 12013825 1 N2O2C8H13 A2B2C8D13 -22.33 5.29 0.0 0.0 0
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51191 12013826 2 NOC6H6 ABC6D6 2.36 3.09 -9.68 -0.71 1
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51192 12013827 1 N2O2C12H13 A2B2C12D13 14.55 4.04 0.0 0.0 1
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51193 12013829 1 N2O2H15C17 A2B2C15D17 46.7 8.34 0.0 0.0 0
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51194 12013830 1 O3N4H26C28 A3B4C26D28 -12.2 3.47 -8.38 -1.19 0
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51195 12013831 2 ON2H10C13 AB2C10D13 76.99 4.99 -8.7 -1.06 0
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51196 12013832 1 O2N6H30C39 A2B6C30D39 144.39 3.62 -8.25 -1.17 0
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51197 12013833 2 ON4H20C26 AB4C20D26 247.72 7.29 -7.94 -1.49 0
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51198 12013834 1 N4O5H18C24 A4B5C18D24 -84.68 3.49 -9.25 -0.85 0
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51199 12013836 1 N4O5H30C44 A4B5C30D44 5.61 2.17 -8.8 -0.81 0
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51200 12013837 1 N4O5H30C38 A4B5C30D38 -79.99 3.26 -8.99 -0.72 0
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51201 12013839 1 ON2C18H32 AB2C18D32 -78.6 3.96 -8.36 2.25 0
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51202 12013840 1 ON2C23H34 AB2C23D34 -47.62 1.58 -8.39 0.36 0
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51203 12013841 1 SN2O3C19H20 AB2C3D19E20 -53.32 0.75 -8.7 -0.55 0
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51204 12013842 1 FSN2O3C19H19 ABC2D3E19F19 -100.15 2.16 -8.8 -0.65 0
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51205 12013843 1 SN2O4C20H22 AB2C4D20E22 -92.66 2.32 -8.26 -0.46 0
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51206 12013844 1 SN2O3C20H22 AB2C3D20E22 -64.67 1.2 -8.45 -0.44 0
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51207 12013846 1 ClSN2O3C19H19 ABC2D3E19F19 -68.77 3.39 -8.8 -0.59 0
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51208 12013847 1 FSN2O3C19H19 ABC2D3E19F19 -108.97 1.93 -8.86 -0.6 0
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51209 12013848 1 SN2O4C20H22 AB2C4D20E22 -94.78 1.61 -8.33 -0.6 0
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51210 12013849 1 SN2O3C20H22 AB2C3D20E22 -64.55 1.49 -8.65 -0.6 0
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51211 12013851 2 OC12H12 AB12C12 13.46 2.92 -8.32 0.13 0
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51212 12013852 2 ClH9C11 AB9C11 74.04 3.1 -9.12 -0.42 0
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51213 12013853 6 FH3C4 AB3C4 -231.32 4.67 -9.31 -0.73 0
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51214 12013854 2 NOC6H7 ABC6D7 -35.85 2.17 -10.12 -0.38 0
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51215 12013855 1 ClSO4C36H39 ABC4D36E39 -62.84 7.04 -8.12 -0.3 0
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51216 12013856 1 S2F3O4C19H33 A2B3C4D19E33 -336.52 13.73 -9.26 -0.36 0
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51217 12013857 2 BrNO3C20H24 ABC3D20E24 -121.47 3.46 -8.48 -0.02 0
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51218 12013858 1 O2C7H14 A2B7C14 -79.72 2.53 -10.37 1.6 0
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51220 12013860 1 PH15C19 AB15C19 130.27 1.88 -8.55 -0.31 0
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51221 12013861 2 NOH7C9 ABC7D9 34.64 9.86 -7.86 -1.26 0
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51222 12013862 1 O2N3H27C28 A2B3C27D28 74.89 7.99 -8.88 -1.4 0
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51223 12013863 1 N2O3H32C33 A2B3C32D33 -6.14 4.2 -8.19 -0.39 0
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51224 12013864 1 N3O3H31C33 A3B3C31D33 5.68 7.25 -8.5 -0.59 0
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51225 12013865 1 ON2H12C19 AB2C12D19 47.23 7.04 -8.61 -1.4 0
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51226 12013866 1 N2O4H12C19 A2B4C12D19 -21.23 3.06 -9.19 -1.95 0
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51227 12013867 1 N2O2H14C19 A2B2C14D19 -16.41 3.65 -8.38 -1.51 0
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51228 12013868 1 BrN2H15C26 AB2C15D26 135.99 4.13 -8.96 -1.74 0
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51229 12013869 1 O2N3H25C31 A2B3C25D31 60.92 6.25 -8.51 -0.54 0
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51230 12013870 1 Br2O2N4H20C23 A2B2C4D20E23 -0.01 6.36 -9.29 -1.13 0
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51231 12013871 2 BrON2H11C12 ABC2D11E12 -5.77 12.48 -9.12 -1.2 0
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51232 12013872 1 SC9H10 AB9C10 38.49 2.13 -8.97 -0.25 0
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51233 12013873 1 OSC10H12 ABC10D12 1.65 2.87 -8.8 -0.14 0