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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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294800 117497012 1 BrNO2C14H18 ABC2D14E18 -78.61 2.66 -8.8 -0.31 0
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294801 117497014 1 BrNO2C14H18 ABC2D14E18 -46.72 4.07 -8.99 -0.21 0
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294802 117497031 1 BrNO2C14H18 ABC2D14E18 -48.42 4.31 -8.84 -0.35 0
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294803 117497038 1 BrNO2C14H18 ABC2D14E18 -43.0 1.75 -8.82 -0.14 0
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294804 117497046 1 BrNO2C14H18 ABC2D14E18 -76.91 5.62 -9.1 -0.22 0
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294805 117497047 1 BrNO2C14H18 ABC2D14E18 -85.08 5.55 -8.78 -0.22 0
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294806 117497059 1 BrNO2C14H18 ABC2D14E18 -74.67 3.22 -7.78 0.0 0
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294807 117497189 1 BrNO2C14H18 ABC2D14E18 -41.15 2.15 -8.79 -0.16 0
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294808 117497328 1 BrNOC15H22 ABCD15E22 -46.37 1.86 -9.09 -0.2 0
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294809 117497538 1 BrNOC15H22 ABCD15E22 -44.18 2.38 -9.17 -0.09 0
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294810 117497574 1 BrNSC14H18 ABCD14E18 33.95 2.52 -8.52 -0.35 0
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294811 117497606 1 N2O4H16C17 A2B4C16D17 -82.89 11.3 -8.93 -0.95 0
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294812 117497641 2 FNOC8H11 ABCD8E11 -164.99 5.36 -8.74 -0.18 0
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294813 117498120 1 BrO4C13H13 AB4C13D13 -124.3 6.39 -9.22 -0.65 0
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294814 117498121 1 BrO4C13H13 AB4C13D13 -123.73 3.5 -8.92 -0.41 0
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294815 117498172 1 BrN2O3C12H13 AB2C3D12E13 -33.46 6.56 -8.51 -0.31 0
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294816 117498275 1 BrO3C14H17 AB3C14D17 -103.53 4.19 -9.14 -0.48 0
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294817 117498408 1 BrO3C14H17 AB3C14D17 -113.34 4.51 -9.28 -0.54 0
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294818 117498488 1 BrN2O2C13H17 AB2C2D13E17 -42.64 2.3 -8.62 -0.49 0
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294819 117498515 1 BrN2O2C13H17 AB2C2D13E17 -49.17 2.43 -8.99 -0.23 0
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294820 117498529 1 Cl2S2O3C10H10 A2B2C3D10E10 -101.23 4.58 -9.2 -1.31 0
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294821 117498532 1 BrOSN2C12H13 ABCD2E12F13 33.89 1.12 -8.77 -0.7 0
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294822 117498549 1 BrO2C15H21 AB2C15D21 -83.1 4.01 -9.28 -0.27 0
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294823 117498594 1 BrON2C14H21 ABC2D14E21 -35.55 4.02 -8.59 0.2 0
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294824 117498614 1 BrON2C14H21 ABC2D14E21 -15.91 5.35 -8.77 -0.13 0
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294825 117498643 1 BrON2C14H21 ABC2D14E21 -37.27 2.46 -8.8 0.0 0
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294826 117498710 1 FO2N3H16C17 AB2C3D16E17 -26.23 4.4 -8.48 -0.43 0
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294827 117498997 1 BrNO5H8C11 ABC5D8E11 -88.61 2.43 -8.69 -2.2 0
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294828 117499002 1 BrN3O4H8C10 AB3C4D8E10 -33.97 5.56 -9.0 -1.77 0
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294829 117499013 1 BrNO2F3C10H11 ABC2D3E10F11 -231.32 5.48 -9.51 -0.67 0
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294830 117499021 1 BrNO2F3C10H11 ABC2D3E10F11 -187.46 3.13 -9.8 -1.01 0
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294831 117499043 1 BrFNO3H9C12 ABCD3E9F12 -91.82 5.92 -9.26 -0.93 0
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294832 117499045 1 BrFNO3H9C12 ABCD3E9F12 -106.49 3.29 -9.05 -0.83 0
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294833 117499046 1 BrFNO3H9C12 ABCD3E9F12 -105.04 3.72 -9.06 -0.82 0
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294834 117499052 1 BrFO2N3H9C11 ABC2D3E9F11 -46.41 5.45 -8.72 -0.59 0
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294835 117499053 1 BrFO2N3H9C11 ABC2D3E9F11 -42.08 4.08 -8.69 -0.8 0
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294836 117499059 1 BrFO2N3H9C11 ABC2D3E9F11 -46.47 4.09 -8.62 -1.04 0
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294837 117499067 1 BrNO4C12H12 ABC4D12E12 -96.89 5.36 -9.14 -0.67 0
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294838 117499071 1 BrNO4C12H12 ABC4D12E12 -100.79 6.81 -9.21 -1.02 0
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294839 117499101 1 BrN3O3C11H12 AB3C3D11E12 -18.09 3.97 -8.81 -0.77 0
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294840 117499103 1 BrN3O3C11H12 AB3C3D11E12 -25.02 4.14 -8.67 -0.61 0
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294841 117499154 1 BrFNO2C13H13 ABCD2E13F13 -82.86 2.54 -9.69 -0.74 0
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294842 117499216 1 BrNO3C13H16 ABC3D13E16 -93.65 4.24 -9.3 -0.77 0
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294843 117499217 1 BrNO3C13H16 ABC3D13E16 -96.23 4.53 -9.15 -0.5 0
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294844 117499226 1 BrNO3C13H16 ABC3D13E16 -103.44 2.86 -8.52 -0.4 0
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294845 117499295 1 BrNO3C13H16 ABC3D13E16 -87.1 4.34 -9.38 -0.51 0
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294846 117499656 1 BrNO2C14H20 ABC2D14E20 -49.58 0.74 -9.04 -0.26 0
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294847 117500086 1 SO6C14H18 AB6C14D18 -221.0 8.13 -9.63 -1.14 0
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294848 117500297 1 ClSN2O3C13H15 ABC2D3E13F15 -101.6 3.77 -8.64 -1.21 0
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294849 117500298 1 ClSN2O3C13H15 ABC2D3E13F15 -100.36 4.46 -8.86 -1.06 0