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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