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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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413109 135086053 1 NO2C14H17 AB2C14D17 -33.55 3.59 -8.62 -0.3 0
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413110 135086054 1 NO2C16H21 AB2C16D21 -62.89 5.68 -9.65 0.04 0
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413111 135086055 1 N2O4C17H20 A2B4C17D20 -24.12 4.89 -9.77 -1.38 0
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413112 135086056 1 O7C23H24 A7B23C24 -126.12 3.84 -8.55 -0.49 0
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413113 135086057 1 SO3C10H10 AB3C10D10 -62.49 8.06 -9.45 -0.19 0
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413114 135086058 1 NH9C12 AB9C12 117.68 4.46 -9.59 -0.46 0
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413115 135086059 1 OSiC12H20 ABC12D20 -103.31 1.77 -8.74 0.6 0
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413116 135086060 1 BSiO3C18H25 ABC3D18E25 -212.0 1.32 -9.05 0.07 0
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413117 135086061 1 BrN2O2H13C16 AB2C2D13E16 -11.77 3.82 -9.07 -0.99 0
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413118 135086062 1 N2O3H16C18 A2B3C16D18 -55.15 2.81 -9.07 -1.13 0
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413119 135086063 1 FOH15C18 ABC15D18 -32.68 4.1 -9.62 -0.66 0
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413120 135086064 1 O4C21H22 A4B21C22 -99.14 6.81 -8.27 -0.32 0
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413121 135086065 1 OSF3H15C20 ABC3D15E20 -116.13 7.38 -8.27 -0.72 0
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413122 135086066 1 OF4H10C16 AB4C10D16 -177.36 4.0 -9.93 -1.07 0
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413123 135086067 1 OSF3H9C14 ABC3D9E14 -124.82 3.66 -9.36 -1.11 0
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413124 135086068 2 O3C9H11 A3B9C11 -208.64 0.69 -8.61 -0.04 7
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413126 135086070 1 NO2F3C12H12 AB2C3D12E12 -212.75 6.0 -9.0 -0.39 0
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413127 135086071 1 Cl2O3H14C21 A2B3C14D21 -48.19 0.93 -9.67 -0.76 0
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413128 135086072 1 FO3H17C22 AB3C17D22 -90.75 3.2 -9.61 -0.57 0
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413130 135086074 1 O4C19H24 A4B19C24 -105.52 3.56 -9.46 0.14 0
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413131 135086075 1 SN2O6C16H18 AB2C6D16E18 -48.03 2.11 -10.4 -2.1 0
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413132 135086076 1 NSO4C17H21 ABC4D17E21 -82.93 5.83 -9.73 -0.67 0
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413133 135086077 1 SN2O4C17H18 AB2C4D17E18 -24.66 4.05 -9.57 -1.95 0
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413134 135086078 1 SiF2O2C20H20 AB2C2D20E20 -138.94 2.76 -9.54 -0.22 0
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413135 135086079 1 NPO3H18C21 ABC3D18E21 -76.82 3.93 -9.22 -0.53 0