List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
295850 117545687 1 BrNOC13H18 ABCD13E18 -12.71 3.06 -9.5 -0.36 0
295851 117545814 1 NO2C15H23 AB2C15D23 -64.51 5.19 -8.74 0.1 0
295852 117545816 1 NOC9H19 ABC9D19 -53.31 4.01 -9.42 2.14 0
295853 117545849 1 BrNOC13H18 ABCD13E18 -9.44 3.18 -9.09 -0.35 0
295854 117545855 1 ClNO2C14H20 ABC2D14E20 -60.09 2.89 -8.94 -0.28 0
295855 117545856 1 NO2C15H23 AB2C15D23 -60.42 2.54 -8.61 0.24 0
295856 117545864 1 NO2C16H25 AB2C16D25 -65.0 2.83 -8.66 0.17 0
295857 117545888 1 ON2C15H24 AB2C15D24 -17.28 3.51 -8.29 0.22 0
295858 117545933 1 NOC15H23 ABC15D23 -29.68 3.69 -9.27 0.24 0
295859 117545975 1 NOSC11H17 ABCD11E17 -14.32 2.46 -9.28 -0.36 0
295860 117546002 1 BrNOC13H18 ABCD13E18 -17.18 1.52 -9.48 -0.36 0
295861 117546021 1 NOC12H23 ABC12D23 -61.72 2.68 -9.44 2.03 0
295862 117546047 1 BrNOC14H20 ABCD14E20 -17.45 3.41 -9.5 -0.24 0
295863 117546129 1 NO3C15H21 AB3C15D21 -92.23 3.93 -8.81 -0.15 0
295864 117546173 1 NO3C14H19 AB3C14D19 -82.12 4.71 -8.72 0.0 0
295865 117546174 1 NO3C13H17 AB3C13D17 -70.61 2.08 -8.7 -0.01 0
295866 117546178 1 BrNOC12H16 ABCD12E16 -4.94 3.36 -9.29 -0.11 0
295867 117546181 1 NO3C15H23 AB3C15D23 -94.58 3.74 -8.29 -0.01 0
295868 117546236 1 BrNOC13H18 ABCD13E18 -13.13 3.21 -9.2 -0.34 0
295869 117546313 1 ON2C11H14 AB2C11D14 24.37 2.23 -9.46 -0.47 0
295870 117546314 1 ON2C11H14 AB2C11D14 23.84 0.41 -9.52 -0.43 0
295871 117546323 1 NO2C13H17 AB2C13D17 -27.79 3.87 -9.1 -0.02 0
295872 117546327 1 ClNOC12H14 ABCD12E14 3.99 0.43 -9.43 -0.4 0
295873 117546335 1 NO3C13H15 AB3C13D15 -50.36 2.27 -8.96 -0.33 0
295874 117546341 1 FNOC12H14 ABCD12E14 -34.45 1.83 -9.43 -0.36 0
295875 117546342 1 NO3C15H21 AB3C15D21 -72.27 4.7 -8.82 -0.12 0
295876 117546366 1 NOC12H21 ABC12D21 -31.94 2.63 -9.25 1.95 0
295877 117546395 1 NO3C15H21 AB3C15D21 -85.3 0.95 -8.35 -0.05 0
295878 117546402 1 NO2C16H23 AB2C16D23 -64.12 4.75 -8.78 0.12 0
295879 117546404 1 ClNO2C14H18 ABC2D14E18 -54.99 5.56 -9.0 -0.36 0
295880 117546415 1 NOC9H17 ABC9D17 -43.88 3.89 -9.22 2.09 0
295881 117546422 1 NO2C11H15 AB2C11D15 -37.42 3.44 -9.28 0.2 0
295882 117546425 1 ON2C12H16 AB2C12D16 5.42 2.38 -9.41 -0.31 0
295883 117546428 1 NOC14H19 ABC14D19 -13.83 3.04 -9.15 0.11 0
295884 117546434 1 NO2C14H19 AB2C14D19 -46.1 2.65 -8.97 -0.06 0
295885 117546454 1 ON2C15H18 AB2C15D18 10.58 2.94 -8.48 0.01 0
295886 117546462 1 NOC15H21 ABC15D21 -23.63 3.44 -9.09 0.17 0
295887 117546488 1 NO2C15H21 AB2C15D21 -51.54 3.37 -8.86 0.07 0
295888 117546495 1 NO2C16H23 AB2C16D23 -58.39 1.62 -8.84 0.11 0
295889 117546496 1 NO2C16H23 AB2C16D23 -57.35 3.16 -8.65 0.08 0
295890 117546500 1 BrNOC14H18 ABCD14E18 -5.05 4.22 -8.92 -0.34 0
295891 117546531 1 NO2C15H21 AB2C15D21 -51.82 4.55 -8.88 0.0 0
295892 117546581 1 NO3C15H19 AB3C15D19 -75.89 3.66 -8.91 -0.26 0
295893 117546677 1 NOC9H17 ABC9D17 -43.82 3.14 -9.12 2.05 0
295894 117546702 1 BrNOC15H20 ABCD15E20 -13.6 2.96 -9.01 -0.36 0
295895 117546710 1 NOC12H23 ABC12D23 -57.98 1.59 -8.95 2.15 0
295896 117546736 1 FNOC15H20 ABCD15E20 -66.56 1.21 -9.03 -0.29 0
295897 117546738 1 NOC17H25 ABC17D25 -36.66 2.43 -8.96 0.29 0
295898 117546780 1 ON2C14H14 AB2C14D14 31.65 4.81 -8.72 -0.33 0
295899 117546781 1 ON2C14H14 AB2C14D14 30.97 3.35 -8.75 -0.26 0