List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
338797 127259808 2 OC11H13 AB11C13 -75.31 2.04 -9.44 0.2 0
338798 127259809 1 NO3C21H25 AB3C21D25 -85.21 1.66 -8.73 0.08 0
338799 127259810 1 ClO3C18H19 AB3C18D19 -94.87 2.54 -9.46 -0.03 0
338800 127259811 1 ClO3H21C23 AB3C21D23 -80.55 2.72 -9.0 -0.08 0
338801 127259812 1 N2O3C22H28 A2B3C22D28 -117.1 2.23 -9.31 0.33 0
338802 127259813 1 ClNO3C20H30 ABC3D20E30 -182.12 1.58 -8.98 0.13 0
338803 127259814 1 NO3C20H29 AB3C20D29 -148.36 1.13 -9.02 0.09 0
338804 127259815 1 NCl2O2C22H29 AB2C2D22E29 -109.37 4.73 -9.65 -0.1 0
338805 127259816 1 ClNO2C22H28 ABC2D22E28 -70.9 2.71 -9.15 0.11 0
338806 127259817 1 NSO2H17C19 ABC2D17E19 -13.61 2.23 -9.08 -0.82 0
338807 127259818 1 O2H22C23 A2B22C23 -27.41 1.58 -9.26 0.13 0
338808 127259819 1 NO4H17C18 AB4C17D18 -125.22 6.46 -9.81 -0.54 0
338809 127259820 1 ClSO4C15H19 ABC4D15E19 -179.77 2.89 -9.35 -0.36 0
338810 127259821 1 ClNSO2C15H16 ABCD2E15F16 -54.15 1.99 -8.98 -0.13 0
338811 127259822 1 NO4H13C17 AB4C13D17 -115.12 4.88 -10.14 -1.14 0
338812 127259823 1 NO5C14H17 AB5C14D17 -185.39 3.15 -9.73 -0.26 0
338813 127259824 1 O3C16H22 A3B16C22 -139.49 2.87 -9.63 0.1 0
338814 127259825 1 NO2C23H23 AB2C23D23 -17.72 2.41 -9.03 -0.09 0
338815 127259826 1 N2O2C23H32 A2B2C23D32 -68.21 4.07 -8.33 0.17 0
338816 127259827 1 NH17C18 AB17C18 119.03 5.01 -9.26 -0.46 0
338817 127259828 1 NO4C18H19 AB4C18D19 -67.06 4.78 -9.54 -1.46 0
338818 127259829 1 NO4H19C21 AB4C19D21 -41.7 3.9 -9.5 -1.65 0
338819 127259830 1 NO2C22H29 AB2C22D29 -66.85 2.79 -8.78 0.36 0
338820 127259831 1 NCl2O2C21H25 AB2C2D21E25 -80.76 2.55 -8.5 0.02 0
338821 127259832 1 O3C13H18 A3B13C18 -135.96 1.8 -9.47 0.3 0
338822 127259833 2 SH6C7 AB6C7 70.64 1.49 -8.72 -1.2 0
338823 127259834 1 NS2H9C14 AB2C9D14 112.73 4.54 -9.05 -1.55 0
338824 127259835 1 OS2H12C14 AB2C12D14 29.81 2.37 -8.85 -1.33 0
338825 127259836 1 O3S3H14C15 A3B3C14D15 -35.77 6.14 -8.85 -1.32 0
338826 127259837 1 NSO3H11C13 ABC3D11E13 -52.24 11.65 -8.76 -1.3 0
338827 127259838 1 NSO2H13C14 ABC2D13E14 -25.89 11.16 -8.65 -1.11 0
338828 127259839 1 NSO3H15C19 ABC3D15E19 -14.13 9.16 -8.89 -1.7 0
338829 127259840 1 NSO2F3H10C14 ABC2D3E10F14 -170.09 8.14 -9.51 -1.95 0
338830 127259841 1 NSO2H11C13 ABC2D11E13 -7.35 8.08 -9.18 -1.69 0
338831 127259842 1 NOSH19C21 ABCD19E21 55.54 5.35 -8.28 -0.87 0
338832 127259843 1 NOSH13C14 ABCD13E14 26.27 3.09 -8.48 -1.14 0
338833 127259844 1 SN2O2H12C15 AB2C2D12E15 75.09 6.63 -8.83 -1.68 0
338834 127259845 1 BrNOSH10C13 ABCDE10F13 37.28 4.0 -8.64 -1.36 0
338835 127259846 1 BrClNOSH9C13 ABCDEF9G13 28.34 3.57 -8.83 -1.65 0
338836 127259847 1 ClSN2O2H11C15 ABC2D2E11F15 65.55 5.12 -8.99 -1.78 0
338837 127259848 1 SN2O2H14C16 AB2C2D14E16 64.98 5.66 -8.77 -1.7 0
338838 127259849 1 SN2O2C16H20 AB2C2D16E20 13.78 7.28 -8.58 -1.26 0
338839 127259850 1 OSC21H26 ABC21D26 -16.8 3.38 -8.94 -1.0 0
338840 127259851 1 SO2C26H34 AB2C26D34 -59.53 4.61 -9.09 -1.15 0
338841 127259852 1 OSC17H18 ABC17D18 -8.59 1.11 -9.02 -0.7 0
338842 127259853 1 OSC18H20 ABC18D20 -13.33 1.32 -8.8 -0.64 0
338843 127259854 1 SO3C18H18 AB3C18D18 -89.7 4.98 -9.12 -1.32 0
338844 127259855 1 SO3C19H20 AB3C19D20 -94.28 4.95 -9.1 -1.34 0
338845 127259856 1 SO3C16H16 AB3C16D16 -58.88 2.89 -9.05 -1.13 0
338846 127259857 1 ON2H18C21 AB2C18D21 60.62 3.81 -9.49 -0.33 0
338847 127259858 1 ON2H20C22 AB2C20D22 53.73 4.24 -9.45 -0.42 0
338848 127259859 1 SN2C11H16 AB2C11D16 27.71 6.97 -7.62 -0.09 0
338849 127259860 1 OCl3N4H7C11 AB3C4D7E11 70.93 6.27 -9.52 -1.24 0
338850 127259861 1 ClON4H11C15 ABC4D11E15 100.02 3.62 -9.09 -1.08 0
338851 127259862 1 OCl2N5H7C10 AB2C5D7E10 89.95 5.52 -10.18 -1.44 0
338852 127259863 1 SN2C9H12 AB2C9D12 36.64 6.93 -7.97 -0.57 0
338853 127259864 2 NOF2C6H6 ABC2D6E6 -194.04 0.64 -9.08 -1.14 0
338854 127259865 1 ClN3H12C13 AB3C12D13 108.48 1.93 -9.24 -0.53 0
338855 127259866 1 FN3C7H8 AB3C7D8 48.12 3.37 -9.03 -0.27 0
338856 127259867 1 N4C15H18 A4B15C18 93.06 6.94 -8.32 0.07 0
338857 127259868 1 NC20H25 AB20C25 43.05 0.74 -8.82 0.39 0
338858 127259869 1 OSC12H16 ABC12D16 -27.92 3.08 -8.86 -0.36 0
338859 127259870 1 OSC16H24 ABC16D24 -47.96 3.07 -8.89 -0.38 0
338860 127259871 1 O2N4C17H20 A2B4C17D20 56.58 6.6 -9.4 -1.13 0
338861 127259872 1 ON2C16H24 AB2C16D24 -30.06 2.63 -9.0 0.44 0
338862 127259873 1 ClNOC11H16 ABCD11E16 -57.76 4.93 -9.76 -0.02 0
338863 127259874 2 O2C6H7 A2B6C7 -159.88 1.66 -9.49 0.25 0
338864 127259875 1 FSO3C15H15 ABC3D15E15 -136.83 5.84 -9.32 -0.85 0
338865 127259876 1 SO3C11H16 AB3C11D16 -120.81 3.66 -9.43 0.16 0
338866 127259877 1 O3C16H24 A3B16C24 -148.57 2.26 -9.34 0.4 0
338867 127259878 1 NC29H33 AB29C33 81.05 1.69 -8.95 0.39 0
338868 127259879 1 NSO3C21H21 ABC3D21E21 -65.03 6.7 -9.18 -0.63 0
338869 127259880 1 N5H13C14 A5B13C14 114.56 7.77 -9.22 -0.88 0
338870 127259881 1 ClSO2N3C11H16 ABC2D3E11F16 -47.33 4.38 -8.53 -0.15 0
338871 127259882 1 ClNSO5H10C13 ABCD5E10F13 -84.9 1.91 -9.69 -1.59 0