List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
28123 825728 1 SN4C8H8 AB4C8D8 75.58 3.4 -8.39 -0.53 0
28124 825732 1 NO3C14H17 AB3C14D17 -105.82 2.49 -8.1 -0.13 0
28125 825744 2 N2H9C11 A2B9C11 162.56 9.79 -8.63 -2.42 0
28126 825748 1 NSO2C14H17 ABC2D14E17 -47.59 2.25 -8.65 -0.49 0
28127 825752 2 OC6H9 AB6C9 -112.69 1.06 -9.42 1.77 0
28128 825754 1 ClN2O3C15H15 AB2C3D15E15 -52.13 3.47 -8.99 -0.63 0
28129 825760 1 ClN2S2H3C5 AB2C2D3E5 67.21 4.9 -9.23 -1.68 0
28130 825768 1 NO3C11H13 AB3C11D13 -113.84 7.19 -9.03 -0.88 0
28131 825769 1 ClO2N3C16H16 AB2C3D16E16 -11.3 1.63 -9.14 -0.78 0
28132 825777 1 Cl2H16C17 A2B16C17 35.07 2.15 -9.53 0.15 0
28133 825783 1 BrO2C10H17 AB2C10D17 -124.67 3.35 -10.6 -0.38 0
28134 825784 1 BrO2C10H17 AB2C10D17 -124.7 6.01 -10.39 -0.15 0
28135 825795 1 O2C15H22 A2B15C22 -118.13 5.55 -9.27 -0.13 0
28136 825797 1 BrO2H7C10 AB2C7D10 -0.7 1.84 -9.85 -1.24 0
28137 825798 1 BrO2C13H13 AB2C13D13 -26.46 2.22 -9.73 -1.03 0
28138 825800 1 ClO2H7C10 AB2C7D10 -12.91 1.88 -9.78 -1.21 0
28139 825802 1 O3C17H20 A3B17C20 -95.1 1.24 -9.04 -0.05 0
28140 825808 1 BrNO2C8H8 ABC2D8E8 1.96 3.83 -10.01 -1.51 0
28141 825814 1 NO3H7C10 AB3C7D10 -8.06 3.79 -9.28 -1.67 0
28142 825824 1 NO6C17H19 AB6C17D19 -113.81 2.58 -8.74 -0.5 0
28143 825825 1 NO6C17H19 AB6C17D19 -116.37 7.34 -8.86 -0.48 0
28144 825826 1 N2O4C19H22 A2B4C19D22 -88.62 7.11 -8.49 -0.63 0
28145 825827 2 NO2C9H10 AB2C9D10 -96.75 2.38 -8.71 -0.71 0
28146 825834 1 SN3O5C13H13 AB3C5D13E13 -80.39 9.1 -9.18 -1.21 0
28147 825850 1 NO5C17H21 AB5C17D21 -149.83 6.07 -9.61 -1.43 0
28148 825854 1 O3C11H18 A3B11C18 -156.24 6.23 -10.46 0.63 0
28149 825855 1 NO4H11C15 AB4C11D15 -23.17 2.93 -9.96 -1.76 0
28150 825858 1 O4H18C19 A4B18C19 -128.97 0.96 -10.0 -0.63 0
28151 825880 1 OSN2H16C17 ABC2D16E17 2.27 4.01 -8.43 -0.8 0
28152 825895 2 NO2H4C5 AB2C4D5 4.56 3.94 -8.85 -1.32 0
28153 825897 1 O8C11H16 A8B11C16 -345.1 4.32 -10.66 -0.11 0
28154 825903 1 NOH13C14 ABC13D14 22.66 5.01 -8.37 -0.33 0
28155 825909 1 ON2C19H24 AB2C19D24 -8.17 1.99 -8.31 0.09 0
28156 825914 1 ON2C19H24 AB2C19D24 -11.1 5.52 -9.07 -0.51 0
28157 825917 1 NSO4C11H15 ABC4D11E15 -81.89 5.16 -10.51 -1.8 0
28158 825920 1 NSO4C10H11 ABC4D10E11 -120.84 7.82 -9.67 -0.89 0
28159 825921 1 NO3H11C13 AB3C11D13 7.82 5.02 -8.97 -1.38 0
28160 825926 1 ON2H12C14 AB2C12D14 19.21 1.33 -8.8 -0.76 0
28161 825929 1 NSO2H15C20 ABC2D15E20 9.91 4.83 -8.64 -1.2 0
28162 825932 1 NOC16H17 ABC16D17 7.36 2.47 -8.93 -0.39 0
28163 825935 1 N2O3H10C12 A2B3C10D12 -17.02 9.74 -9.08 -1.5 0
28164 825938 1 BrNO2C8H8 ABC2D8E8 1.77 6.48 -10.06 -0.86 0
28165 825939 1 N2O3H10C12 A2B3C10D12 -15.9 5.41 -9.06 -1.53 0
28166 825948 1 NSO2C17H21 ABC2D17E21 -58.53 5.46 -9.21 -0.34 0
28167 825956 1 NO5C11H13 AB5C11D13 -116.63 5.2 -9.79 -1.66 0
28168 825967 3 NC5H9 AB5C9 -11.55 1.23 -8.32 2.7 0
28169 825970 1 SN2O4C13H18 AB2C4D13E18 -159.12 4.18 -9.11 -0.52 0
28170 825978 2 NOC10H12 ABC10D12 -27.41 4.36 -8.74 -0.66 0
28171 825981 1 SN2O2C18H22 AB2C2D18E22 -59.99 5.89 -8.5 -0.55 0
28172 825983 2 NOC10H12 ABC10D12 -28.62 5.41 -8.82 -0.68 0
28173 825986 1 SN2O2C18H22 AB2C2D18E22 -59.88 6.03 -8.52 -0.56 0
28174 826003 1 NO4H17C18 AB4C17D18 -121.18 1.99 -8.89 -0.19 0
28175 826014 1 NO2C13H13 AB2C13D13 -69.7 4.0 -8.93 -0.61 0
28176 826015 1 NO4C13H15 AB4C13D15 -152.11 1.32 -8.59 -0.1 0
28177 826027 1 NO3C14H17 AB3C14D17 -123.11 2.88 -8.98 -0.1 0
28178 826029 1 NO3C15H17 AB3C15D17 -115.41 4.42 -8.54 -0.56 0
28179 826080 1 O2C11H20 A2B11C20 -130.77 5.4 -10.46 0.75 0
28180 826087 1 O4C9H14 A4B9C14 -199.03 5.42 -10.87 0.27 0
28181 826088 1 BrNCl2H12C14 ABC2D12E14 21.57 2.28 -9.39 -1.12 0
28182 826090 1 O2C13H18 A2B13C18 -96.05 5.63 -9.62 -0.13 0
28183 826092 1 O2C13H18 A2B13C18 -96.07 5.62 -9.62 -0.12 0
28184 826095 1 NCl2O2C17H17 AB2C2D17E17 -73.23 3.06 -9.59 -1.23 0
28185 826100 1 NCl2C15H15 AB2C15D15 9.33 2.17 -9.02 -0.76 0
28186 826104 2 NOC6H9 ABC6D9 -1.36 5.46 -9.31 -1.19 0
28187 826108 1 BrNOC13H14 ABCD13E14 -25.77 7.07 -8.78 -0.65 0
28188 826111 1 N2O3C16H24 A2B3C16D24 -73.96 9.11 -9.07 -0.6 0
28189 826142 1 N2O2C15H16 A2B2C15D16 -50.97 2.72 -8.33 -0.49 0
28190 826143 4 OC4H6 AB4C6 -164.86 1.64 -8.52 0.32 0
28191 826144 4 OC4H6 AB4C6 -162.06 1.61 -8.51 0.35 0
28192 826153 1 SN2O2C16H18 AB2C2D16E18 -44.81 5.13 -8.62 -0.65 0
28193 826158 1 O2C15H22 A2B15C22 -95.47 0.98 -8.6 0.4 0
28194 826159 1 SN2O2C16H18 AB2C2D16E18 -46.4 5.99 -8.57 -0.6 0
28195 826166 1 O3C16H24 A3B16C24 -120.28 2.37 -8.52 0.41 0
28196 826172 1 NO2C14H19 AB2C14D19 -93.03 2.48 -8.89 0.11 0
28197 826196 1 NO3C11H15 AB3C11D15 -59.43 6.44 -9.64 -1.15 0
28198 826204 1 NO2C11H15 AB2C11D15 -74.02 6.41 -9.16 -0.51 0
28199 826230 1 SN6C8H12 AB6C8D12 91.05 4.39 -9.1 -0.55 0
28200 826237 1 NO2H15C17 AB2C15D17 -7.16 4.21 -8.43 -0.55 0
28201 826239 1 ClNOC19H22 ABCD19E22 -11.21 4.66 -9.04 0.1 0
28202 826253 1 NO2C21H25 AB2C21D25 -41.64 1.55 -8.57 -0.31 0
28203 826254 1 NO2C12H13 AB2C12D13 -71.03 7.63 -8.6 -0.31 0
28204 826265 1 ClON2C11H11 ABC2D11E11 -11.58 2.57 -9.14 -0.9 0
28205 826268 1 ClON2H7C9 ABC2D7E9 -5.05 2.39 -9.32 -1.09 0
28206 826273 2 NC5H10 AB5C10 -16.64 2.86 -7.96 2.99 0
28207 826282 1 NO5C11H13 AB5C11D13 -114.87 8.53 -9.84 -1.16 0
28208 826283 1 NO3C9H11 AB3C9D11 -115.21 6.03 -9.27 -0.32 0
28209 826312 1 ClN2O2H9C11 AB2C2D9E11 -32.82 2.78 -9.15 -0.75 0
28210 826315 1 ClN2O2H11C12 AB2C2D11E12 -41.84 2.81 -8.91 -0.49 0
28211 826317 1 N3O4H11C12 A3B4C11D12 -37.92 9.43 -9.71 -1.49 0
28212 826324 1 ClON2C11H11 ABC2D11E11 -0.78 5.16 -8.82 -0.4 0
28213 826326 1 SN5C12H13 AB5C12D13 106.79 4.17 -8.07 -0.94 0
28214 826329 2 NC5H6 AB5C6 52.62 5.84 -9.13 -0.51 0
28215 826332 1 NSC15H17 ABC15D17 35.32 1.24 -8.62 -0.25 0
28216 826341 1 ClOSH15C16 ABCD15E16 -7.74 2.74 -8.58 -0.37 0
28217 826342 1 NOSC16H19 ABCD16E19 8.47 2.85 -8.23 -0.07 0
28218 826368 1 BrOSC17H17 ABCD17E17 -16.01 3.22 -8.63 -0.45 0
28219 826372 1 FOSH15C17 ABCD15E17 -51.76 3.09 -8.93 -0.86 0
28220 826382 1 NOC19H23 ABC19D23 0.09 2.82 -8.81 0.04 0
28221 826385 1 NSC14H15 ABC14D15 43.64 1.56 -8.49 -0.3 0
28222 826390 1 SN2O3C16H20 AB2C3D16E20 -103.31 4.44 -8.37 -0.77 0