List Systems

Back
Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
338095 127258726 1 NO3C7H13 AB3C7D13 -95.3 3.57 -9.89 -0.07 0
338096 127258727 1 ClNO2C15H20 ABC2D15E20 -88.14 0.98 -9.1 -0.14 0
338097 127258728 1 NCl2O2C11H11 AB2C2D11E11 -73.75 0.95 -9.24 -0.42 0
338098 127258729 1 ClNO2C15H20 ABC2D15E20 -95.49 0.61 -9.09 -0.1 0
338099 127258730 1 ClNO2C14H18 ABC2D14E18 -85.84 0.92 -9.14 -0.15 0
338100 127258731 1 NCl2O2C12H13 AB2C2D12E13 -78.42 0.99 -9.22 -0.42 0
338101 127258732 1 ClNO2C14H18 ABC2D14E18 -89.64 1.11 -8.96 -0.08 0
338102 127258733 1 ClNO2C11H12 ABC2D11E12 -72.45 0.52 -9.14 -0.17 0
338103 127258734 1 ClNO3C11H12 ABC3D11E12 -124.58 2.77 -9.94 -0.4 0
338104 127258735 1 ClNO2C16H16 ABC2D16E16 -55.09 1.24 -8.85 -0.62 0
338105 127258797 1 ClNO2C15H20 ABC2D15E20 -83.35 1.29 -9.22 -0.31 0
338106 127258798 1 NO2C17H25 AB2C17D25 -93.38 2.09 -8.91 0.1 0
338107 127258799 1 NO2C23H37 AB2C23D37 -124.76 1.8 -8.95 0.2 0
338108 127258800 1 NSO2C17H25 ABC2D17E25 -86.84 3.5 -8.59 -0.28 0
338109 127258801 1 NO2C16H23 AB2C16D23 -86.09 2.25 -9.14 0.02 0
338110 127258802 1 NO2C16H17 AB2C16D17 -43.5 2.36 -8.8 -0.56 0
338111 127258803 1 NO3C15H21 AB3C15D21 -112.96 2.91 -8.85 -0.15 0
338112 127258804 1 NO2C15H21 AB2C15D21 -78.15 2.59 -9.09 0.02 0
338113 127258805 1 ClNO2C12H14 ABC2D12E14 -68.32 1.11 -9.24 -0.32 0
338114 127258806 1 NO2C14H19 AB2C14D19 -79.31 1.04 -8.9 0.11 0
338115 127258807 1 NO2C18H27 AB2C18D27 -99.65 1.78 -9.04 0.14 0
338116 127258808 1 NO2C16H23 AB2C16D23 -90.14 1.75 -9.05 0.13 0
338117 127258809 2 NOC7H10 ABC7D10 -62.69 0.75 -8.24 0.18 0
338118 127258810 1 NSO2C14H19 ABC2D14E19 -71.84 3.56 -8.6 -0.28 0
338119 127258811 1 NO2H13C14 AB2C13D14 -34.13 2.51 -8.79 -0.55 0
338120 127258812 1 NO2C13H17 AB2C13D17 -76.03 1.72 -9.03 0.04 0
338121 127258813 1 NCl2O2H9C10 AB2C2D9E10 -67.42 3.01 -9.3 -0.65 0
338122 127258814 1 NO2C12H15 AB2C12D15 -68.66 1.62 -9.1 0.02 0
338123 127258815 1 NO4C13H15 AB4C13D15 -131.37 2.36 -9.22 -0.22 0
338124 127258816 1 NO2S2C14H17 AB2C2D14E17 -54.33 2.74 -8.52 -0.2 0
338125 127258817 1 NO2C15H21 AB2C15D21 -78.07 2.69 -9.06 0.05 0
338126 127258818 1 NO3C13H17 AB3C13D17 -103.15 2.91 -8.84 -0.14 0
338127 127258819 1 NO2C13H17 AB2C13D17 -68.58 2.64 -9.09 0.03 0
338128 127258820 1 NO2C14H19 AB2C14D19 -73.25 2.53 -9.1 0.01 0
338129 127258821 1 ClNO4C13H16 ABC4D13E16 -142.68 0.92 -9.08 -0.31 0
338130 127258822 1 NO2C13H15 AB2C13D15 -41.14 2.28 -9.18 -0.08 0
338131 127258823 1 NO3C14H19 AB3C14D19 -102.49 3.47 -8.74 -0.03 0
338132 127258824 1 ClNO2C10H10 ABC2D10E10 -58.88 1.23 -9.22 -0.3 0
338133 127258825 1 NO2C16H21 AB2C16D21 -70.71 2.53 -9.09 0.02 0
338134 127258826 1 NO3C12H15 AB3C12D15 -92.57 2.12 -8.9 -0.12 0
338135 127258827 1 NO2C12H15 AB2C12D15 -63.39 2.08 -9.16 -0.08 0
338136 127258828 1 FNO2C10H10 ABC2D10E10 -95.19 1.09 -9.25 -0.29 0
338137 127258829 1 NO2C14H19 AB2C14D19 -78.78 2.01 -8.97 0.07 0
338138 127258830 1 NO2C12H15 AB2C12D15 -69.56 2.27 -8.89 0.13 0
338139 127258831 1 NO2C18H27 AB2C18D27 -100.33 1.76 -8.96 0.19 0
338140 127258832 1 NO2C16H23 AB2C16D23 -90.66 1.61 -9.02 0.16 0
338141 127258833 1 NCl2O2H9C10 AB2C2D9E10 -70.24 4.05 -9.49 -0.61 0
338142 127258834 1 NO2C14H19 AB2C14D19 -80.28 1.94 -9.06 0.12 0
338143 127258835 1 NO2C12H15 AB2C12D15 -72.65 1.78 -9.06 0.15 0
338144 127258836 1 NO2C14H19 AB2C14D19 -75.8 2.53 -9.07 0.1 0
338145 127258837 1 NO2C13H17 AB2C13D17 -70.75 1.43 -9.11 0.06 0
338146 127258838 2 NOC6H8 ABC6D8 -52.8 3.38 -8.32 0.18 0
338147 127258839 1 NO3C11H13 AB3C11D13 -93.36 3.82 -8.99 -0.04 0
338148 127258840 1 NSO2C12H15 ABC2D12E15 -62.22 2.53 -8.54 -0.25 0
338149 127258841 1 NO2C14H19 AB2C14D19 -81.52 1.88 -9.04 0.15 0
338150 127258842 1 NO2C11H13 AB2C11D13 -61.79 2.52 -9.11 0.05 0
338151 127258843 1 NO4C13H15 AB4C13D15 -126.85 3.39 -9.38 -0.75 0
338152 127258844 1 NSO2C11H13 ABC2D11E13 -52.18 2.6 -8.52 -0.31 0
338153 127258845 1 NSO3C13H15 ABC3D13E15 -89.57 3.24 -8.8 -0.71 0
338154 127258846 1 BrClNO2H9C10 ABCD2E9F10 -55.07 3.26 -9.35 -0.76 0
338155 127258847 1 BrNO2C10H10 ABC2D10E10 -48.8 3.76 -9.29 -0.4 0
338156 127258848 2 NO2C5H5 AB2C5D5 -56.91 8.1 -9.69 -1.38 0
338157 127258849 1 N2O4C13H16 A2B4C13D16 -161.2 4.75 -9.44 -0.06 0
338158 127258850 1 NO2C12H23 AB2C12D23 -119.37 2.46 -9.14 0.75 0
338159 127258851 1 NO4C26H53 AB4C26D53 -287.28 1.5 -9.95 0.48 0
338160 127258852 1 BrN2O4C13H15 AB2C4D13E15 -65.46 8.77 -9.68 -1.59 0
338161 127258853 1 ClN2O4C14H17 AB2C4D14E17 -84.61 7.3 -9.51 -1.36 0
338162 127258854 1 N2O2C19H28 A2B2C19D28 -56.9 2.06 -9.02 0.36 0
338163 127258855 1 N2O2C15H24 A2B2C15D24 -89.25 3.49 -8.7 0.4 0
338164 127258856 2 NOC7H11 ABC7D11 -78.9 3.98 -8.78 0.35 0
338165 127258857 1 NO2C13H23 AB2C13D23 -113.88 2.81 -9.6 1.0 0
338166 127258858 1 ClN2O4C15H17 AB2C4D15E17 -81.67 8.54 -9.65 -1.62 0
338167 127258859 1 NaN2O3C10H11 AB2C3D10E11 -159.39 10.38 -9.02 -0.84 0
338168 127258860 1 SN2O4C9H12 AB2C4D9E12 -170.27 4.55 -9.61 -0.73 0
338169 127258861 1 N4O4H20C23 A4B4C20D23 -28.91 3.65 -9.03 -0.91 0