List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
295150 117518718 1 BrN2O5H11C13 AB2C5D11E13 -110.05 4.43 -9.52 -1.32 0
295151 117518719 1 BrN2O5H11C13 AB2C5D11E13 -121.8 4.78 -9.4 -1.52 0
295152 117518770 1 BrN2O4C14H15 AB2C4D14E15 -100.4 11.64 -9.0 -0.79 0
295153 117518793 1 BrO4C16H19 AB4C16D19 -117.55 4.24 -8.8 -0.49 0
295154 117518847 1 BrO4C16H19 AB4C16D19 -134.05 3.8 -9.03 -0.57 0
295155 117518880 1 BrO3C17H23 AB3C17D23 -129.14 3.68 -9.31 -0.35 0
295156 117518881 1 BrO3C17H23 AB3C17D23 -144.64 3.88 -8.81 -0.21 0
295157 117518889 1 BrO3C17H23 AB3C17D23 -134.57 4.21 -9.23 -0.48 0
295158 117518908 1 BrN2O2C16H23 AB2C2D16E23 -29.89 2.92 -8.61 -0.2 0
295159 117518945 1 BrN2O2C16H23 AB2C2D16E23 -57.08 1.26 -8.76 -0.12 0
295160 117519045 1 BrNO4C15H18 ABC4D15E18 -121.58 4.1 -8.9 -0.13 0
295161 117519382 1 BrNO5C14H16 ABC5D14E16 -182.31 5.02 -9.0 -0.65 0
295162 117519387 1 BrSN3O3C12H12 ABC3D3E12F12 -23.98 4.35 -9.06 -1.48 0
295163 117519508 1 BrO5C15H19 AB5C15D19 -169.77 4.92 -8.57 -0.31 0
295164 117519533 1 BrO5C15H19 AB5C15D19 -199.24 2.37 -8.96 -0.49 0
295165 117519559 1 BrO4C16H23 AB4C16D23 -170.38 6.25 -8.8 -0.24 0
295166 117519599 1 BrNO5C14H18 ABC5D14E18 -175.93 7.89 -8.91 -0.68 0
295167 117519652 1 S2O6C15H20 A2B6C15D20 -245.08 4.76 -10.12 -0.98 0
295168 117519656 3 OC8H8 AB8C8 -35.5 1.34 -8.85 -0.01 0
295169 117519708 1 NO2C24H27 AB2C24D27 -11.0 1.7 -8.92 -0.15 0
295170 117520125 1 BrN2O2C17H23 AB2C2D17E23 -33.34 3.81 -8.62 0.02 0
295171 117520155 1 BrClSO3C13H16 ABCD3E13F16 -123.3 3.95 -9.43 -1.14 0
295172 117520227 1 BrNO3C17H22 ABC3D17E22 -104.71 6.11 -8.98 -0.42 0
295173 117520243 1 BrNO2C18H26 ABC2D18E26 -81.9 4.07 -8.5 -0.07 0
295174 117520266 1 BrNO2C18H26 ABC2D18E26 -79.36 4.23 -8.69 -0.08 0
295175 117520320 1 BrO4C17H21 AB4C17D21 -147.99 6.52 -9.06 -0.62 0
295176 117520364 1 BrO4C17H21 AB4C17D21 -114.32 1.65 -8.52 -0.18 0
295177 117520495 1 BrO5C16H19 AB5C16D19 -178.42 4.27 -8.82 -0.82 0
295178 117520573 1 BrSN3O3C13H14 ABC3D3E13F14 -40.79 8.38 -8.7 -0.4 0
295179 117520609 1 BrO5C16H21 AB5C16D21 -202.73 5.95 -9.19 -0.5 0
295180 117520611 1 BrO5C16H21 AB5C16D21 -201.44 1.86 -9.17 -0.62 0
295181 117520623 1 NO2C25H27 AB2C25D27 -13.72 2.51 -8.47 0.09 0
295182 117520631 1 NO2C25H27 AB2C25D27 -11.52 1.47 -8.37 0.16 0
295183 117520738 1 BrClSO4H10C13 ABCD4E10F13 -112.83 4.42 -8.85 -1.3 0
295184 117520786 1 BrS2O4C13H15 AB2C4D13E15 -130.58 4.69 -8.78 -1.24 0
295185 117520850 1 BrO3C19H25 AB3C19D25 -137.43 4.39 -9.18 -0.4 0
295186 117520902 1 BrN2O4C16H19 AB2C4D16E19 -104.78 8.33 -8.89 -0.64 0
295187 117520914 1 BrO4C18H23 AB4C18D23 -162.85 4.26 -8.8 -0.44 0
295188 117520950 1 BrClSO4C13H16 ABCD4E13F16 -153.79 6.46 -9.28 -1.15 0
295189 117520953 1 BrClSO4C13H16 ABCD4E13F16 -153.04 5.15 -8.74 -1.12 0
295190 117520960 1 BrNO2F4C14H14 ABC2D4E14F14 -271.04 1.14 -9.13 -1.01 0
295191 117520961 1 BrNO2F4C14H14 ABC2D4E14F14 -270.21 2.36 -9.12 -0.97 0
295192 117520962 1 BrNO4C17H22 ABC4D17E22 -156.42 7.25 -9.21 -0.53 0
295193 117520967 1 BrNO4C17H22 ABC4D17E22 -151.24 3.5 -8.68 -0.32 0
295194 117521020 1 BrNO4H14C18 ABC4D14E18 -45.82 4.58 -9.56 -1.44 0
295195 117521060 1 BrFN2O3H12C17 ABC2D3E12F17 -66.43 2.19 -9.46 -1.11 0
295196 117521128 1 NO5H19C24 AB5C19D24 -51.22 7.17 -8.8 -1.27 0
295197 117521170 1 ClN2C11H11 AB2C11D11 42.99 4.03 -9.63 -0.26 0
295198 117521196 1 ClN2C13H15 AB2C13D15 29.15 4.98 -9.47 -0.19 0
295199 117521202 1 ON2C13H16 AB2C13D16 1.92 3.9 -9.1 0.13 0