List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
220813 85240081 1 ClN2O2H9C14 AB2C2D9E14 -13.78 3.8 -9.41 -1.88 0
220814 85240098 1 NO2C17H23 AB2C17D23 -78.88 4.02 -8.57 -0.13 0
220815 85240099 1 ON3C16H23 AB3C16D23 -31.58 8.4 -8.87 -0.09 0
220816 85240100 1 NSiO3C13H27 ABC3D13E27 -185.99 2.86 -8.96 1.11 0
220818 85240102 1 ClNO2H12C15 ABC2D12E15 -30.55 2.36 -9.32 -0.48 0
220819 85240113 1 O5C14H26 A5B14C26 -270.3 3.78 -9.89 0.66 0
220820 85240122 1 NO4C6H11 AB4C6D11 -160.85 1.2 -9.72 0.72 0
220821 85240124 1 NO4C15H17 AB4C15D17 -128.5 2.47 -8.43 -0.08 0
220822 85240125 1 NO4C15H17 AB4C15D17 -131.33 6.17 -9.8 -0.1 0
220823 85240126 1 N5H13C16 A5B13C16 144.03 1.0 -8.93 -0.77 0
220824 85240127 1 OSN5C12H13 ABC5D12E13 49.88 3.74 -8.75 -0.88 0
220825 85240131 1 NO2C17H25 AB2C17D25 -69.98 2.6 -8.1 0.59 0
220827 85240139 4 OC4H5 AB4C5 -132.54 5.76 -9.11 -0.61 0
220828 85240141 1 N2O3C15H20 A2B3C15D20 -11.37 6.92 -9.56 -1.59 0
220829 85240144 1 O3C17H24 A3B17C24 -113.07 2.29 -9.46 0.26 0
220830 85240145 1 SiO3C15H20 AB3C15D20 -124.86 2.29 -9.64 -0.3 0
220831 85240146 2 OC9H14 AB9C14 -68.32 1.41 -8.36 -0.4 0
220832 85240148 2 NC9H16 AB9C16 -22.48 1.35 -8.49 1.01 0
220833 85240149 1 ClN2O4C11H17 AB2C4D11E17 -175.94 4.3 -9.78 -0.03 0
220834 85240150 1 OSnC10H22 ABC10D22 -72.64 2.29 -8.99 0.99 0
220835 85240154 1 O2N3H11C16 A2B3C11D16 61.02 1.17 -8.3 -1.24 0
220836 85240155 1 O2N3H11C16 A2B3C11D16 50.5 7.43 -9.15 -1.11 0
220837 85240158 1 NO4C15H19 AB4C15D19 -153.68 3.24 -9.14 -1.16 0
220838 85240159 1 NO4C15H19 AB4C15D19 -157.55 4.18 -9.86 -0.42 0
220839 85240160 1 NSO3C14H15 ABC3D14E15 -62.05 6.45 -8.18 -0.18 0
220840 85240161 1 NSO3C14H15 ABC3D14E15 -80.26 3.16 -9.52 -0.79 0
220841 85240162 1 NO3C16H23 AB3C16D23 -128.28 4.92 -9.49 0.23 0
220842 85240163 1 NO3C16H23 AB3C16D23 -118.53 3.78 -9.71 -0.13 0
220844 85240165 1 ON5C14H23 AB5C14D23 14.66 5.5 -8.95 -0.46 0
220845 85240166 1 NO2C17H27 AB2C17D27 -71.52 4.3 -9.05 1.03 0
220846 85240169 1 F3O3C13H17 A3B3C13D17 -312.02 2.95 -10.21 0.27 0
220847 85240171 1 O2N4H8C15 A2B4C8D15 86.47 2.67 -9.72 -3.0 0
220848 85240172 1 O7C12H22 A7B12C22 -310.08 1.47 -9.74 1.12 0
220849 85240174 1 SO3C15H18 AB3C15D18 -75.72 5.62 -8.55 -0.21 0
220850 85240177 1 O3C17H26 A3B17C26 -160.88 5.87 -9.68 0.87 0
220851 85240178 1 O3C17H26 A3B17C26 -151.14 3.17 -8.64 0.4 0
220852 85240180 1 O3C17H26 A3B17C26 -130.07 1.89 -9.02 0.57 0
220853 85240181 1 OC20H22 AB20C22 15.78 2.84 -9.11 0.26 0
220854 85240188 1 NO4C15H21 AB4C15D21 -171.28 2.26 -9.52 0.21 0
220855 85240190 1 ON3C17H17 AB3C17D17 71.62 3.66 -8.82 -0.08 0
220856 85240192 1 SO2N3C13H17 AB2C3D13E17 -45.54 2.3 -8.65 -0.09 0
220857 85240193 1 SO2N3C13H17 AB2C3D13E17 -19.38 2.37 -8.76 -0.42 0
220858 85240194 1 NOC19H21 ABC19D21 6.79 4.14 -9.18 -0.16 0
220860 85240197 1 NSiO3C14H21 ABC3D14E21 -88.22 4.26 -9.3 -0.26 0
220861 85240198 1 NO2C17H29 AB2C17D29 -98.1 4.88 -10.22 0.72 0
220862 85240212 2 NO2C7H10 AB2C7D10 -127.94 1.2 -9.42 0.07 0
220863 85240214 1 ON4C16H16 AB4C16D16 98.4 1.23 -8.75 -0.46 0
220864 85240221 1 O3C17H28 A3B17C28 -152.83 2.79 -8.98 1.42 0
220865 85240222 1 O3C17H28 A3B17C28 -135.34 2.41 -9.18 0.77 0
220867 85240224 1 SSiO2C14H20 ABC2D14E20 -32.06 3.06 -9.19 -0.58 0