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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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233161 87692701 1 O5C20H34 A5B20C34 -235.67 8.88 -9.17 -1.18 0
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233162 87692705 1 ClNSO4C15H22 ABCD4E15F22 -187.45 6.45 -9.66 -0.38 0
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233163 87692707 1 FO2N3H24C27 AB2C3D24E27 6.15 3.55 -8.39 -0.73 0
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233164 87692740 1 O3C10H14 A3B10C14 -76.83 1.7 -10.29 -0.22 0
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233165 87692751 1 PO3C9H15 AB3C9D15 -135.88 3.09 -9.67 0.44 0
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233166 87692752 1 PO3C9H15 AB3C9D15 -149.13 3.22 -9.08 0.63 0
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233167 87692760 1 O2N3F6C17H21 A2B3C6D17E21 -386.94 8.46 -9.86 -0.76 1
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233168 87692768 1 PO6C7H16 AB6C7D16 -298.4 5.26 0.0 0.0 0
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233169 87692771 1 OC12H12 AB12C12 6.76 1.33 -8.63 -0.23 0
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233170 87692776 1 NO4C9H9 AB4C9D9 -90.99 3.01 -10.68 -1.58 0
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233171 87692782 1 FS2N4O8C41H43 AB2C4D8E41F43 -222.62 8.08 -8.58 -0.95 0
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233172 87692787 1 N3O3F6H23C25 A3B3C6D23E25 -361.53 4.25 -9.18 -1.61 0
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233173 87692793 1 BrF3N5O6C57H61 AB3C5D6E57F61 -256.94 11.09 -8.26 -0.76 0
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233174 87692799 1 OSN3C12H13 ABC3D12E13 8.18 0.73 -8.75 -1.18 0
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233175 87692808 1 NSO3H15C16 ABC3D15E16 -61.8 5.59 -8.77 -0.25 0
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233176 87692809 1 FO2N4C22H27 AB2C4D22E27 -96.47 4.65 -8.92 -1.22 0
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233177 87692812 1 ClSO2N5C21H30 ABC2D5E21F30 -52.63 8.15 -8.74 -0.88 0
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233178 87692854 1 S2O3N4C16H18 A2B3C4D16E18 -77.78 6.56 -9.31 -0.74 0
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233179 87692855 1 SN3F6H17C24 AB3C6D17E24 -190.68 8.49 -9.2 -1.33 0
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233180 87692858 1 N2O3C26H28 A2B3C26D28 -64.06 9.29 -8.57 -0.75 0
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233181 87692862 2 C2O2N3H6 A2B2C3D6 -90.01 1.56 -9.73 0.08 0
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233182 87692903 1 O9C63H104 A9B63C104 -466.13 7.47 -9.14 0.11 0
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233183 87692905 1 IOF3N4H12C14 ABC3D4E12F14 -110.36 5.1 -9.3 -1.73 0
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233184 87692907 1 O6C13H20 A6B13C20 -289.07 3.76 -10.42 0.47 0
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233185 87692919 1 OH28C48 AB28C48 174.86 1.57 -8.51 -0.83 0