List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
279800 103845215 1 N3C14H23 A3B14C23 29.53 2.37 -8.99 0.88 0
279801 103845217 1 N2C17H20 A2B17C20 50.97 3.94 -9.1 -0.74 0
279802 103845218 1 NSC14H21 ABC14D21 13.19 0.95 -8.97 0.1 0
279803 103845220 1 ClN3C15H18 AB3C15D18 48.14 0.97 -9.16 -0.89 0
279804 103845227 2 NC9H13 AB9C13 24.05 2.33 -8.88 0.44 0
279805 103845228 1 N2O2C15H26 A2B2C15D26 -108.0 3.26 -9.1 0.87 0
279806 103845230 1 ON2C15H20 AB2C15D20 -19.42 4.54 -9.24 -0.22 0
279807 103845234 1 NSC15H21 ABC15D21 22.78 2.41 -8.5 -0.05 0
279808 103845236 1 NO2C16H23 AB2C16D23 -55.07 1.31 -8.18 0.17 0
279809 103845239 1 NOC16H23 ABC16D23 -24.66 0.5 -8.43 0.43 0
279810 103845241 1 ClNO2C16H22 ABC2D16E22 -61.48 2.52 -8.78 -0.32 0
279811 103845242 1 SN2O2C12H16 AB2C2D12E16 23.59 6.82 -9.39 -1.58 0
279812 103845245 1 NOC17H25 ABC17D25 -33.5 2.08 -8.64 0.47 0
279813 103845248 1 NO2C15H21 AB2C15D21 -57.77 3.17 -8.61 0.15 0
279814 103845251 1 NO2C16H23 AB2C16D23 -63.81 1.83 -8.2 0.28 0
279815 103845255 1 NO3C17H25 AB3C17D25 -91.79 2.9 -7.97 0.1 0
279816 103845257 1 NF2C14H17 AB2C14D17 -69.07 4.01 -9.31 -0.27 0
279817 103845260 2 N2C8H11 A2B8C11 61.59 2.14 -8.7 -0.32 0
279818 103845261 1 NSC14H21 ABC14D21 7.14 1.4 -8.79 0.27 0
279819 103845265 1 SN3C15H25 AB3C15D25 19.15 1.12 -8.37 0.0 0
279820 103845266 1 NO3C17H23 AB3C17D23 -85.27 1.86 -8.36 0.29 0
279821 103845268 1 NOC17H25 ABC17D25 -32.45 0.95 -8.5 0.43 0
279822 103845269 1 N3C17H21 A3B17C21 61.68 5.65 -9.21 -0.55 0
279823 103845270 1 NOC16H21 ABC16D21 -16.98 1.24 -8.57 0.27 0
279824 103845272 1 N2O2C17H30 A2B2C17D30 -125.95 1.41 -9.06 1.01 0
279825 103845275 1 NSO2C17H23 ABC2D17E23 -51.82 3.91 -8.43 -0.26 0
279826 103845278 1 SN3C15H19 AB3C15D19 70.22 3.96 -9.07 -0.72 0
279827 103845279 1 N3C17H21 A3B17C21 72.22 3.32 -8.89 -0.5 0
279828 103845280 1 NC12H23 AB12C23 -25.21 1.29 -8.81 1.48 0
279829 103845281 1 ClN2O2C14H17 AB2C2D14E17 6.83 2.35 -9.18 -1.56 0
279830 103845286 1 ON2C18H26 AB2C18D26 -17.22 1.27 -8.24 0.35 0
279831 103845287 1 NO2C14H19 AB2C14D19 -71.64 3.13 -8.75 0.2 0
279832 103845288 1 BrNO2C16H22 ABC2D16E22 -47.51 5.42 -8.42 -0.09 0
279833 103845293 1 N3C14H23 A3B14C23 22.86 4.05 -8.73 0.99 0
279834 103845294 4 NC4H5 AB4C5 76.33 3.3 -9.11 -0.75 0
279835 103845296 2 NC9H13 AB9C13 19.42 1.94 -7.92 0.61 0
279836 103845297 1 FNOC15H20 ABCD15E20 -60.96 3.75 -8.8 0.06 0
279837 103845302 2 NOC8H14 ABC8D14 -118.34 3.91 -9.17 1.0 0
279838 103845303 1 NOC17H21 ABC17D21 43.63 2.1 -8.85 0.23 0
279839 103845307 1 ClNO2C16H20 ABC2D16E20 -58.28 1.17 -8.82 -0.15 0
279840 103845312 2 NC6H11 AB6C11 -5.02 1.89 -8.79 1.46 0
279841 103845313 1 N3C13H21 A3B13C21 22.59 4.31 -9.04 0.72 0
279842 103845314 1 ON3C14H23 AB3C14D23 -2.94 3.66 -8.86 0.45 0
279843 103845319 1 FN2C15H17 AB2C15D17 8.5 4.63 -9.36 -0.93 0
279844 103845323 1 NO2C17H25 AB2C17D25 -57.38 1.35 -8.12 0.42 0
279845 103845325 1 BrNO2C16H22 ABC2D16E22 -51.98 2.16 -8.53 -0.16 0
279846 103845326 2 NOC8H11 ABC8D11 -56.8 3.87 -8.95 -0.1 0
279847 103845328 1 N3C17H23 A3B17C23 40.74 3.62 -8.78 -0.03 0
279848 103845330 1 NF2C14H17 AB2C14D17 -72.75 1.73 -9.07 -0.39 0
279849 103845331 1 ClNO2C16H22 ABC2D16E22 -60.38 3.77 -8.42 -0.01 0
279850 103845333 1 N2C19H28 A2B19C28 16.0 3.27 -8.56 0.52 0
279851 103845334 1 ClN2O2C14H17 AB2C2D14E17 9.44 5.42 -9.36 -1.55 0
279852 103845335 1 BrN2O2C14H17 AB2C2D14E17 20.16 6.89 -9.4 -1.01 0
279853 103845336 1 NO2C16H23 AB2C16D23 -60.18 3.41 -8.78 0.46 0
279854 103845340 1 SN3C16H19 AB3C16D19 71.15 2.18 -9.02 -1.04 0
279855 103845345 1 N4C11H18 A4B11C18 57.55 3.88 -9.16 0.32 0
279856 103845350 1 O2N3C14H21 A2B3C14D21 -75.38 3.63 -9.18 -0.38 0
279857 103845352 1 N3C12H19 A3B12C19 31.88 2.48 -9.04 0.85 0
279858 103845355 1 NOC15H21 ABC15D21 -16.82 0.86 -8.62 0.34 0
279859 103845359 1 NO2C18H25 AB2C18D25 -65.25 5.39 -8.21 0.0 0
279860 103845367 1 N2C19H28 A2B19C28 18.46 2.29 -8.84 0.4 0
279861 103845373 1 SN3C15H21 AB3C15D21 42.96 4.16 -8.54 -0.23 0
279862 103845374 1 NC11H19 AB11C19 11.7 1.32 -8.96 1.4 0
279863 103845377 1 SN2O3C10H20 AB2C3D10E20 -134.5 5.13 -9.2 0.38 0
279864 103845379 1 SN2O3C17H28 AB2C3D17E28 -140.04 3.82 -9.17 -0.15 0
279865 103845381 1 N3O4C16H27 A3B4C16D27 -150.59 5.35 -9.35 0.18 0
279866 103845385 1 N2O3C16H30 A2B3C16D30 -175.51 4.92 -8.84 1.04 0
279867 103845395 1 O3N4C14H24 A3B4C14D24 -112.52 7.08 -9.58 0.7 0
279868 103845411 1 O3N4C15H26 A3B4C15D26 -131.28 4.06 -9.08 0.66 0
279869 103845419 1 O3N4C15H26 A3B4C15D26 -110.42 7.38 -9.04 0.78 0
279870 103845444 1 N3O3C17H31 A3B3C17D31 -150.01 6.17 -9.28 0.88 0
279871 103845445 1 ClN2O3C17H25 AB2C3D17E25 -140.2 2.95 -9.38 -0.04 0
279872 103845451 1 N3O3C16H25 A3B3C16D25 -120.7 3.27 -9.33 0.04 0
279873 103845452 1 N2O3C17H26 A2B3C17D26 -131.2 3.08 -9.12 0.38 0
279874 103845478 1 ON2C13H24 AB2C13D24 -62.98 2.49 -9.14 1.3 0
279875 103845495 1 ON2C17H24 AB2C17D24 -22.13 1.8 -9.24 -0.61 0
279876 103845497 1 ON2C16H24 AB2C16D24 -32.62 3.92 -8.33 0.11 0
279877 103845500 1 NOC17H27 ABC17D27 -59.54 3.35 -8.87 0.47 0
279878 103845501 1 BrNOC15H24 ABCD15E24 -58.08 3.28 -8.77 -0.16 0
279879 103845502 1 BrNO2C15H24 ABC2D15E24 -85.78 5.3 -8.83 -0.14 0
279880 103845503 1 BrNO3C15H22 ABC3D15E22 -107.23 4.28 -8.94 -0.45 0
279881 103845505 1 NOSC15H25 ABCD15E25 -48.72 3.85 -8.54 -0.14 0
279882 103845507 1 NO2C16H27 AB2C16D27 -91.9 2.27 -8.62 0.33 0
279883 103845519 1 NOC16H25 ABC16D25 -33.77 3.59 -9.02 0.16 0
279884 103845527 1 NOC16H27 ABC16D27 -64.27 2.53 -8.93 0.45 0
279885 103845528 1 ClNO2C14H22 ABC2D14E22 -105.09 5.02 -8.8 -0.16 0
279886 103845529 1 ON3C16H25 AB3C16D25 -24.56 4.51 -8.66 -0.32 0
279887 103845531 1 BrON2C13H21 ABC2D13E21 -35.97 2.95 -9.38 -0.51 0
279888 103845536 1 NO2C17H27 AB2C17D27 -94.94 3.26 -8.7 0.26 0
279889 103845542 1 NO2C17H29 AB2C17D29 -103.54 1.48 -8.57 0.38 0
279890 103845547 1 ON3C12H23 AB3C12D23 -49.87 4.03 -8.98 0.78 0
279891 103845554 1 ON3C17H25 AB3C17D25 1.03 2.0 -8.94 -0.45 0
279892 103845558 1 OSN2C15H28 ABC2D15E28 -60.62 2.72 -9.04 -0.28 0
279893 103845559 1 NO3C16H27 AB3C16D27 -124.83 2.33 -8.89 -0.07 0
279894 103845560 1 NO3C14H23 AB3C14D23 -142.29 4.36 -8.79 0.18 0
279895 103845564 1 N2O3C14H30 A2B3C14D30 -189.7 3.98 -9.18 0.81 0
279896 103845574 1 NO3C17H27 AB3C17D27 -123.72 3.19 -8.8 0.13 0
279897 103845575 1 BrNO2C12H20 ABC2D12E20 -75.33 3.79 -9.22 -0.02 0
279898 103845577 1 OF2N3C12H21 AB2C3D12E21 -139.69 2.4 -9.58 0.17 0
279899 103845583 1 ClNO3C16H24 ABC3D16E24 -128.96 5.15 -8.78 -0.17 0