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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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144754 53408140 1 ClFNOC8H9 ABCDE8F9 -93.04 2.11 -9.31 -0.73 0
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144755 53408342 1 Br2O3H10C12 A2B3C10D12 -86.9 2.87 -9.18 -1.42 0
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144756 53408389 1 BrClN3H5C8 ABC3D5E8 54.45 2.05 -9.1 -1.29 0
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144757 53408502 1 ClNO2C11H14 ABC2D11E14 -104.48 5.06 -9.33 -0.19 0
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144758 53408810 1 FON2C11H17 ABC2D11E17 -80.83 2.47 -8.46 -0.09 0
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144759 53408811 1 FON2C10H15 ABC2D10E15 -71.57 3.18 -8.65 -0.06 0
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144760 53408812 1 N2O3C10H14 A2B3C10D14 -112.28 3.32 -9.22 -0.88 0
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144761 53408839 1 ClON3C8H12 ABC3D8E12 -24.11 3.22 -9.16 -0.76 0
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144762 53409110 1 BrO3C9H9 AB3C9D9 -106.17 4.65 -9.51 -0.68 0
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144763 53409193 1 BrClNOC12H15 ABCDE12F15 -44.72 1.82 -8.88 -0.18 0
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144764 53409310 1 NOC13H19 ABC13D19 -34.06 2.39 -8.59 0.25 0
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144765 53409420 1 NO2C13H19 AB2C13D19 -68.42 2.87 -8.81 0.3 0
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144766 53409436 1 INOC10H12 ABCD10E12 17.09 1.85 -9.34 -0.85 0
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144767 53409437 1 ClINOC12H17 ABCDE12F17 -45.5 3.57 -9.06 -0.76 0
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144768 53409979 1 ClNOC16H24 ABCD16E24 -55.42 1.97 -8.66 0.01 0
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144769 53410368 1 BrClFNO3C12H14 ABCDE3F12G14 -180.41 2.48 -9.26 -0.67 0
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144770 53410427 1 NO3C15H21 AB3C15D21 -122.17 1.81 -8.91 0.27 0
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144771 53410688 1 ClN2O2C6H15 AB2C2D6E15 -125.98 2.61 -9.18 0.87 0
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144772 53410938 1 N3O5C14H21 A3B5C14D21 -214.97 3.46 -9.66 -0.84 -1
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144773 53411053 1 O2C12H21 A2B12C21 -98.87 0.91 0.0 0.0 0
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144774 53411054 2 OC6H11 AB6C11 -120.11 5.04 -10.33 0.5 0
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144775 53411125 1 FO2H9C13 AB2C9D13 -43.23 2.95 -9.6 -1.29 0
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144776 53411367 1 NO5C17H23 AB5C17D23 -226.14 4.19 -9.09 0.16 0
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144777 53411368 1 N2O7C16H20 A2B7C16D20 -218.13 11.28 -9.85 -1.55 0
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144778 53411734 1 N2O5C18H26 A2B5C18D26 -217.42 5.24 -9.58 -0.26 0