List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
212770 81061809 1 NO2C13H27 AB2C13D27 -122.81 1.94 -8.79 1.93 0
212771 81061811 1 FNO3C15H18 ABC3D15E18 -107.79 3.58 -9.51 -0.91 0
212772 81061818 1 ON3C11H23 AB3C11D23 -33.65 1.58 -9.07 0.98 0
212773 81061826 1 ON3C16H31 AB3C16D31 -50.73 1.54 -8.86 1.3 0
212774 81061830 1 N2O3C13H20 A2B3C13D20 -107.79 3.45 -8.43 -0.24 0
212775 81061831 1 O2N3C13H29 A2B3C13D29 -117.71 4.18 -8.75 1.12 0
212776 81061832 1 N2O3C14H28 A2B3C14D28 -128.86 1.76 -8.82 1.09 0
212777 81061833 1 N2O3C13H28 A2B3C13D28 -157.2 1.91 -8.81 0.68 0
212778 81061834 1 N2O3C13H26 A2B3C13D26 -153.04 5.73 -8.88 0.85 0
212779 81061835 1 O2N3C13H29 A2B3C13D29 -116.99 4.56 -8.75 1.24 0
212780 81061836 1 N2O3C12H26 A2B3C12D26 -154.29 6.15 -8.88 0.78 0
212781 81061837 1 N2O3C15H30 A2B3C15D30 -126.13 1.56 -8.76 0.68 0
212782 81061843 1 NO4C15H19 AB4C15D19 -137.47 6.9 -9.55 -1.1 0
212783 81061844 1 NSO4C14H19 ABC4D14E19 -140.96 8.34 -9.38 -1.42 0
212784 81061846 1 O2N3C15H33 A2B3C15D33 -131.29 3.08 -8.79 1.42 0
212785 81061847 1 O2N3C15H31 A2B3C15D31 -100.42 2.69 -8.65 1.18 0
212786 81061848 1 N2O3C14H28 A2B3C14D28 -129.32 1.75 -8.8 1.08 0
212787 81061849 1 SN3O3C12H21 AB3C3D12E21 -99.88 4.15 -8.89 -0.66 0
212788 81061850 1 SN2O3C14H24 AB2C3D14E24 -120.39 8.02 -8.86 -0.15 0
212789 81061851 1 N2O3C14H30 A2B3C14D30 -166.64 2.81 -8.72 0.63 0
212790 81061852 1 N2O3C13H28 A2B3C13D28 -162.62 5.49 -8.95 0.68 0
212791 81061853 1 SN3O3C13H23 AB3C3D13E23 -120.18 3.6 -9.07 -0.51 0
212792 81061854 1 N2O3C11H24 A2B3C11D24 -152.27 5.03 -9.0 0.51 0
212793 81061856 1 NO3C15H21 AB3C15D21 -103.73 6.97 -8.8 -0.7 0
212794 81061857 1 N2O5C13H24 A2B5C13D24 -228.07 4.5 -9.59 0.34 0
212795 81061861 1 ClN2O3C9H17 AB2C3D9E17 -147.34 7.27 -9.62 -0.18 0
212796 81061862 1 OSN4C10H20 ABC4D10E20 -10.81 8.17 -8.17 0.14 0
212797 81061864 1 ClON3C9H14 ABC3D9E14 -15.4 3.95 -9.15 -0.5 0
212798 81061865 1 ClN2O2C11H17 AB2C2D11E17 -71.36 1.63 -8.84 -0.52 0
212799 81061868 1 ClON3C13H20 ABC3D13E20 -14.22 4.98 -8.98 -0.29 0
212800 81061869 1 ClON2C11H17 ABC2D11E17 -33.63 4.73 -8.66 -0.03 0
212801 81061870 1 ClON3C14H18 ABC3D14E18 -3.56 4.73 -8.91 -0.89 0
212802 81061871 1 ClON3C11H18 ABC3D11E18 -24.89 6.11 -8.98 -0.43 0
212803 81061872 1 ClON7C11H16 ABC7D11E16 59.81 6.41 -9.88 -1.38 0
212804 81061873 1 BrNO2C12H24 ABC2D12E24 -106.43 3.42 -9.1 0.12 0
212805 81061874 1 BrNOF3C8H15 ABCD3E8F15 -213.04 3.44 -9.36 -0.93 0
212806 81061875 1 N3O3C8H17 A3B3C8D17 -100.59 2.05 -9.1 0.61 0
212807 81061876 1 BrNOC12H26 ABCD12E26 -83.45 3.21 -8.88 0.15 0
212808 81061877 1 ClNOC12H26 ABCD12E26 -93.8 3.21 -8.84 0.89 0
212809 81061878 1 N3O3C13H25 A3B3C13D25 -108.59 4.16 -9.12 0.62 0
212810 81061879 2 ON2C5H9 AB2C5D9 -61.04 2.07 -9.02 0.15 0
212811 81061880 1 ON2C12H28 AB2C12D28 -73.22 0.85 -8.53 2.17 0
212812 81061884 1 BFNO3C13H21 ABCD3E13F21 -236.58 2.98 -9.14 -0.2 0
212813 81061887 1 FON2C15H21 ABC2D15E21 -34.12 4.44 -9.13 -0.38 0
212814 81061888 1 N4O4C11H18 A4B4C11D18 -119.91 9.2 -9.99 -0.79 0
212815 81061889 1 NSO2C13H19 ABC2D13E19 -12.83 2.68 -8.97 -0.53 0
212816 81061891 1 NSO4C13H21 ABC4D13E21 -160.73 3.13 -9.54 -0.66 0
212817 81061892 1 FNO2C16H22 ABC2D16E22 -75.17 4.28 -9.08 -0.53 0
212818 81061894 2 NOC8H11 ABC8D11 -60.04 4.64 -8.35 0.09 0
212819 81061895 1 NO2C14H23 AB2C14D23 -82.85 2.58 -8.95 0.45 0
212820 81061897 1 NO2C14H29 AB2C14D29 -130.88 2.9 -8.53 2.1 0
212821 81061903 1 NO2C17H29 AB2C17D29 -100.96 1.99 -9.03 0.39 0
212822 81061904 1 NO2C11H25 AB2C11D25 -129.14 2.81 -8.79 2.11 0
212823 81061905 1 NO3C16H21 AB3C16D21 -69.2 4.12 -9.28 -0.49 0
212824 81061907 1 O2N3C14H19 A2B3C14D19 -4.01 3.17 -9.65 -0.93 0
212825 81061908 1 S2N3O3C9H15 A2B3C3D9E15 -82.13 7.95 -8.9 -1.28 0
212826 81061913 1 ON3C12H25 AB3C12D25 -33.96 4.69 -8.84 1.41 0
212827 81061915 1 NSO4C14H19 ABC4D14E19 -106.51 4.28 -9.47 -1.11 0
212828 81061916 1 ON3C10H21 AB3C10D21 -32.08 4.65 -9.16 1.29 0
212829 81061939 1 O2N3C13H27 A2B3C13D27 -77.41 3.18 -8.77 0.97 0
212830 81061945 1 SN2O3C13H22 AB2C3D13E22 -118.79 5.29 -8.65 -0.2 0
212831 81061956 1 NO2C12H25 AB2C12D25 -117.11 2.66 -9.03 1.84 0
212832 81061960 1 ClON5C12H22 ABC5D12E22 -19.78 4.07 -9.09 -0.01 0
212833 81061962 1 ClO3N4C9H13 AB3C4D9E13 -16.66 6.61 -9.72 -1.36 0
212834 81061963 1 ClON5C10H18 ABC5D10E18 -3.77 3.79 -9.25 -0.21 0
212835 81061977 1 ON2C13H30 AB2C13D30 -80.32 2.39 -8.7 2.09 0
212836 81061981 2 NOC7H11 ABC7D11 -79.34 3.6 -8.38 0.43 0
212837 81061985 1 OSN2C14H22 ABC2D14E22 9.6 3.13 -8.87 -0.37 0
212838 81061986 1 NO3C16H23 AB3C16D23 -57.08 3.95 -8.59 -0.12 0
212839 81061992 1 NO2C15H31 AB2C15D31 -135.38 2.93 -8.67 1.99 0
212840 81061993 1 NO2C17H31 AB2C17D31 -129.04 2.17 -8.81 2.0 0
212841 81061998 1 NO3C15H19 AB3C15D19 -57.86 1.81 -9.4 -0.76 0
212842 81062001 1 O2N3C14H19 A2B3C14D19 -1.18 5.43 -9.32 -0.87 0
212843 81062002 2 NOC8H11 ABC8D11 -37.01 4.43 -9.23 -0.43 0
212844 81062003 1 ON3C11H23 AB3C11D23 -39.7 6.48 -9.21 1.5 0