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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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218884 85090109 1 Br2O2N4C21H22 A2B2C4D21E22 95.47 27.05 -6.58 -3.1 2
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218885 85090110 1 O2N4C21H22 A2B4C21D22 105.53 8.52 -5.1 -2.52 0
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218886 85090116 2 SO2N4H9C11 AB2C4D9E11 76.77 1.59 -9.37 -1.79 0
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218887 85090117 1 SSiO6C28H30 ABC6D28E30 -201.72 2.62 -9.1 -1.03 0
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218888 85090118 1 O7C30H50 A7B30C50 -387.5 7.25 -10.01 0.35 0
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218889 85090119 1 SSiO5C28H46 ABC5D28E46 -259.22 2.72 -8.95 0.3 0
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218890 85090121 1 ClO8H23C28 AB8C23D28 -251.99 1.11 -9.92 -0.72 0
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218891 85090122 1 O2F4N5H19C27 A2B4C5D19E27 -9.28 9.19 -9.07 -2.31 0
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218892 85090123 1 S2N5O9H17C19 A2B5C9D17E19 -247.47 14.88 -9.29 -1.59 0
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218893 85090124 1 SN3O7H25C26 AB3C7D25E26 -207.94 10.9 -8.79 -1.74 0
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218894 85090125 1 NSO7C28H29 ABC7D28E29 -205.84 3.23 -9.48 -0.99 0
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218895 85090126 1 NO7C30H37 AB7C30D37 -278.48 7.26 -9.34 -0.23 0
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218896 85090128 1 S2N3O7C23H29 A2B3C7D23E29 -181.91 6.27 -8.31 -1.34 0
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218897 85090130 1 SN3O3H29C31 AB3C3D29E31 7.72 4.92 -8.28 -1.72 0
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218898 85090131 1 O9H20C30 A9B20C30 -257.88 3.87 -8.81 -1.22 0
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218899 85090132 1 O12C25H32 A12B25C32 -512.09 5.35 -8.8 -0.9 0
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218900 85090134 1 O6H32C33 A6B32C33 -169.89 8.07 -9.71 -0.81 0
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218901 85090136 1 N2Cl5H19C25 A2B5C19D25 159.8 3.22 -8.68 -0.29 0
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218902 85090137 1 O2N4C33H40 A2B4C33D40 2.35 3.06 -7.41 -1.4 0
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218903 85090138 1 O7C30H52 A7B30C52 -408.6 2.25 -9.67 0.48 0
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218904 85090139 1 BrClSeSiO3C19H26 ABCDE3F19G26 -115.04 4.32 -8.91 -0.73 0
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218905 85090141 1 ClF2N4O5C24H27 AB2C4D5E24F27 -234.14 6.79 -9.03 -0.64 0
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218906 85090142 1 ClSN2O2H25C31 ABC2D2E25F31 73.2 5.2 -8.04 -1.29 0
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218907 85090143 1 INO2C26H40 ABC2D26E40 -44.92 12.16 -7.18 -1.23 1
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218908 85090144 1 NO2C26H40 AB2C26D40 -94.03 4.17 0.0 0.0 0