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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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147121 53786774 2 SO3N4C8H16 AB3C4D8E16 -164.0 9.38 -9.28 -0.67 0
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147122 53786775 1 N2O6C17H22 A2B6C17D22 -224.29 2.96 -8.97 -0.49 0
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147123 53786776 1 NCl2H21C23 AB2C21D23 62.06 2.71 -8.95 -0.45 0
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147124 53786777 1 O4C29H50 A4B29C50 -278.19 3.28 -10.06 0.94 0
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147125 53786778 2 NO2H10C12 AB2C10D12 -55.23 4.81 -9.79 -1.25 0
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147126 53786779 2 NC6H10 AB6C10 -11.11 0.83 -8.23 0.74 0
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147127 53786780 1 NOH13C15 ABC13D15 28.5 2.0 -8.68 -0.79 0
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147128 53786781 1 OSC15H18 ABC15D18 16.88 3.38 -9.12 -0.14 0
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147129 53786782 1 NO2C10H21 AB2C10D21 -126.89 1.94 -9.68 0.67 0
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147130 53786783 1 N3O3C12H23 A3B3C12D23 -165.68 3.24 -9.56 0.57 1
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147131 53786784 1 O2N6C20H31 A2B6C20D31 -21.86 8.37 0.0 0.0 0
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147132 53786785 1 N2O3C17H18 A2B3C17D18 -70.29 3.01 -9.46 -0.55 0
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147133 53786786 2 NO3H8C9 AB3C8D9 -203.06 8.86 -9.28 -1.38 0
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147134 53786787 1 NO5H17C22 AB5C17D22 -102.25 7.19 -9.27 -1.31 0
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147135 53786788 1 NO6C17H23 AB6C17D23 -260.46 3.65 -9.76 -0.21 0
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147136 53786789 1 NO2C11H25 AB2C11D25 -124.66 2.82 -8.69 2.62 0
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147137 53786790 1 O3C10H18 A3B10C18 -151.0 7.54 -10.52 -0.19 0
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147138 53786791 1 O3C10H18 A3B10C18 -152.59 5.27 -10.42 -0.13 0
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147139 53786792 1 N2C7H14 A2B7C14 19.03 2.68 -8.53 1.25 0
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147140 53786793 1 NSC19H25 ABC19D25 17.61 2.1 -8.2 0.13 0
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147141 53786794 1 O8C25H32 A8B25C32 -354.74 1.87 -9.9 -0.84 0
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147142 53786795 1 S2N7O16H31C36 A2B7C16D31E36 -489.37 8.27 -9.19 -1.5 0
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147143 53786796 1 NO4C8H13 AB4C8D13 -175.88 0.66 -9.94 -0.08 0
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147144 53786797 1 ClSiO5C14H27 ABC5D14E27 -286.76 5.31 -9.26 -0.07 0
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147145 53786798 2 OC5H9 AB5C9 -99.84 3.97 -9.51 0.69 0
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147146 53786799 1 BrO2C9H17 AB2C9D17 -123.21 1.94 -10.52 -0.08 0
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147147 53786800 1 O2C11H16 A2B11C16 -60.53 5.77 -9.61 0.71 0
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147148 53786801 2 NC6H6 AB6C6 53.62 4.26 -9.56 -0.66 0
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147149 53786802 1 ClO2H7C9 AB2C7D9 -36.34 3.92 -9.7 -1.62 0
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147150 53786803 1 NOF2C12H13 ABC2D12E13 -109.78 1.44 -9.71 -0.6 0
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147151 53786804 2 NOC10H12 ABC10D12 -69.6 4.66 -8.87 -0.02 0
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147152 53786805 1 ClNF3O5H25C27 ABC3D5E25F27 -325.46 1.09 -9.86 -1.08 0
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147153 53786806 1 NO5C18H19 AB5C18D19 -183.97 1.21 -9.59 -1.58 0
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147154 53786807 1 NH9C13 AB9C13 70.91 2.21 -8.84 -1.2 0
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147155 53786808 1 O2N3C25H29 A2B3C25D29 -59.17 3.65 -8.76 -0.68 0
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147156 53786809 1 N3O4C16H29 A3B4C16D29 -210.52 2.03 -9.33 0.63 0
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147157 53786810 2 OC7H15 AB7C15 -156.33 2.97 -10.12 2.78 0
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147158 53786811 2 NOC10H10 ABC10D10 53.26 3.91 -9.02 -0.65 1
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147159 53786812 1 N3O3C9H16 A3B3C9D16 -75.57 5.39 0.0 0.0 0
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147160 53786813 1 NO5C20H21 AB5C20D21 -176.01 9.07 -8.91 -0.94 0
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147161 53786814 1 NSO2C24H41 ABC2D24E41 -111.43 2.42 -8.8 0.43 0
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147162 53786815 5 OC7H10 AB7C10 -237.54 5.83 -8.9 -0.57 0
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147163 53786816 1 BrO2C24H31 AB2C24D31 -106.96 1.98 -8.71 -0.22 0
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147164 53786817 1 OC21H30 AB21C30 -25.12 4.81 -8.93 -0.16 0
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147165 53786818 1 NSO4C23H29 ABC4D23E29 -123.64 4.86 -8.6 -0.37 0
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147166 53786819 1 P2C5O5H14 A2B5C5D14 -340.2 1.58 -10.46 1.05 0
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147167 53786820 1 SCl2O4H16C24 AB2C4D16E24 -90.66 5.55 -9.41 -0.74 0
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147168 53786821 1 NO7C43H43 AB7C43D43 -232.2 2.93 -8.98 -0.75 0
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147169 53786822 1 N2O3C19H22 A2B3C19D22 -46.39 2.96 -9.21 -0.06 0
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147170 53786823 1 FO5C26H43 AB5C26D43 -333.54 4.44 -9.86 0.56 0