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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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294850 117500302 1 ClFN2O2C15H20 ABC2D2E15F20 -108.07 6.35 -8.83 -0.27 0
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294851 117500303 1 ClFN2O2C15H20 ABC2D2E15F20 -109.73 4.99 -8.82 -0.13 0
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294852 117500375 1 BrFN2O3H8C11 ABC2D3E8F11 -78.67 2.72 -8.84 -0.85 0
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294853 117500388 1 BrO5H11C12 AB5C11D12 -163.54 7.3 -9.53 -1.62 0
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294854 117500389 1 BrO5H11C12 AB5C11D12 -164.28 6.11 -9.36 -1.25 0
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294855 117500539 1 BrO4C13H15 AB4C13D15 -129.69 3.97 -9.39 -0.61 0
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294856 117500866 1 BrO3C14H19 AB3C14D19 -120.92 4.33 -8.87 -0.23 0
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294857 117500868 1 BrO3C14H19 AB3C14D19 -92.37 2.3 -8.54 -0.17 0
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294858 117500869 1 BrO3C14H19 AB3C14D19 -92.03 4.8 -8.66 -0.25 0
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294859 117500870 1 BrO3C14H19 AB3C14D19 -90.15 1.09 -8.53 -0.22 0
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294860 117500871 1 BrO3C14H19 AB3C14D19 -91.04 2.91 -8.95 -0.4 0
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294861 117500943 1 BrN2O2C13H19 AB2C2D13E19 -46.36 4.75 -8.84 -0.3 0
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294862 117501012 1 N3O5H13C15 A3B5C13D15 -102.01 5.03 -9.35 -1.51 0
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294863 117501060 1 NO2F3C16H20 AB2C3D16E20 -225.92 4.21 -9.08 -0.46 0
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294864 117501082 1 NS2O5C12H13 AB2C5D12E13 -133.82 8.46 -10.18 -0.99 0
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294865 117501492 1 BrNO4C12H14 ABC4D12E14 -110.58 4.03 -9.35 -1.24 0
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294866 117501513 1 BrFNO2C13H15 ABCD2E13F15 -102.32 2.12 -8.91 -0.44 0
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294867 117501514 1 BrFNO2C13H15 ABCD2E13F15 -102.54 3.79 -8.8 -0.56 0
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294868 117501515 1 BrFNO2C13H15 ABCD2E13F15 -101.39 3.46 -8.83 -0.5 0
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294869 117501532 1 BrFNO2C13H15 ABCD2E13F15 -103.03 2.63 -8.93 -0.42 0
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294870 117501560 1 BrFNO2C13H15 ABCD2E13F15 -100.98 1.89 -8.96 -0.69 0
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294871 117501651 1 BrNO3C13H18 ABC3D13E18 -74.57 4.63 -8.5 -0.38 0
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294872 117501696 1 BrNO3C13H18 ABC3D13E18 -99.18 3.77 -9.0 -0.63 0
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294873 117501720 1 BrNO3C13H18 ABC3D13E18 -99.29 4.31 -9.28 -0.75 0
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294874 117501777 1 BrNO3C13H18 ABC3D13E18 -122.6 4.45 -9.61 -0.71 0
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294875 117501785 1 BrNO3C13H18 ABC3D13E18 -83.54 3.26 -8.57 -0.16 0
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294876 117501786 1 BrNO3C13H18 ABC3D13E18 -82.4 3.58 -8.87 -0.3 0
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294877 117501798 1 BrNO3C13H18 ABC3D13E18 -70.13 4.72 -8.46 -0.17 0
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294878 117501954 1 BrNO2C14H22 ABC2D14E22 -80.18 0.64 -8.31 0.08 0
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294879 117502110 1 SO6C14H20 AB6C14D20 -246.82 12.68 -9.7 -0.98 0
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294880 117502121 1 FO3C19H21 AB3C19D21 -149.12 3.44 -9.35 -0.27 0
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294881 117502209 4 NC5H5 AB5C5 109.28 2.7 -8.07 -0.27 0
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294882 117502285 1 BrClNO3H7C11 ABCD3E7F11 -43.43 2.54 -9.88 -1.54 0
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294883 117502288 1 BrClON3C11H11 ABCD3E11F11 20.91 4.39 -8.8 -0.61 0
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294884 117502304 1 ClF2N2O3H11C13 AB2C2D3E11F13 -157.57 7.85 -10.09 -1.34 0
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294885 117502359 1 ClN2S2C14H21 AB2C2D14E21 14.38 5.79 -8.15 -0.18 0
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294886 117502405 1 BrFO4H10C12 ABC4D10E12 -156.71 6.49 -9.29 -0.94 0
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294887 117502407 1 BrFN2O3H10C11 ABC2D3E10F11 -141.61 2.77 -9.24 -0.87 0
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294888 117502481 1 BrO5C12H13 AB5C12D13 -162.18 1.98 -8.93 -1.0 0
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294889 117502492 1 BrO5C12H13 AB5C12D13 -182.38 1.71 -9.08 -0.7 0
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294890 117502599 1 BrFO3C13H14 ABC3D13E14 -169.45 5.95 -9.55 -0.65 0
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294891 117502600 1 BrFO3C13H14 ABC3D13E14 -167.53 3.36 -9.41 -0.74 0
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294892 117502744 1 BrO4C13H17 AB4C13D17 -158.43 2.79 -8.98 -0.39 0
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294893 117502771 1 BrFO2C14H18 ABC2D14E18 -143.5 3.09 -9.77 -0.5 0
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294894 117502803 1 BrFON2C13H18 ABCD2E13F18 -56.52 3.51 -8.77 -0.56 0
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294895 117502846 1 BrO3C14H21 AB3C14D21 -118.84 3.99 -8.89 -0.28 0
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294896 117502853 1 BrO3C14H21 AB3C14D21 -122.81 2.2 -8.98 -0.3 0
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294897 117502886 1 FNSO5C13H16 ABCD5E13F16 -234.1 6.47 -9.6 -1.14 0
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294898 117503055 1 BrClO2C13H14 ABC2D13E14 -87.66 4.87 -9.96 -0.94 0
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294899 117503061 1 BrClO2C13H14 ABC2D13E14 -72.29 5.15 -9.74 -0.7 0