List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
75152 48423092 1 O3N4C23H26 A3B4C23D26 -65.11 4.64 -8.98 0.0 0
75153 48423096 1 O3N5C17H21 A3B5C17D21 -61.54 6.19 -9.53 0.14 0
75154 48423097 1 ClO2N3C15H18 AB2C3D15E18 -28.54 4.53 -9.45 -1.12 0
75155 48423098 1 O2N3C19H25 A2B3C19D25 -23.51 6.0 -9.3 -0.3 0
75156 48423099 1 O3N5C20H21 A3B5C20D21 -37.31 7.14 -9.36 -0.96 0
75157 48423101 1 O3N4C17H22 A3B4C17D22 -80.62 3.88 -9.41 -0.14 0
75158 48423102 1 N3O3C19H29 A3B3C19D29 -126.6 3.09 -8.96 0.44 0
75159 48423103 1 O2N3C13H21 A2B3C13D21 -53.15 5.51 -9.41 0.65 0
75160 48423104 1 O2N3C21H33 A2B3C21D33 -57.2 3.29 -8.35 0.39 0
75161 48423106 1 O2N3C15H23 A2B3C15D23 -48.1 2.44 -8.41 0.1 0
75162 48423107 1 O2N3C19H25 A2B3C19D25 -31.38 6.7 -9.0 -0.21 0
75163 48423108 1 N2O2C15H28 A2B2C15D28 -97.55 2.58 -8.85 0.85 0
75164 48423110 3 NOC6H9 ABC6D9 -129.7 4.2 -9.03 0.12 0
75165 48423112 1 O3N4C17H22 A3B4C17D22 -88.83 7.63 -9.24 -0.12 0
75166 48423113 1 O2N3C16H31 A2B3C16D31 -84.23 3.69 -8.66 0.94 0
75167 48423118 1 O3N4C20H32 A3B4C20D32 -127.15 2.1 -8.19 0.17 0
75168 48423119 2 NOC9H17 ABC9D17 -110.35 4.68 -8.87 1.12 0
75169 48423120 1 N3O3C21H35 A3B3C21D35 -148.44 2.42 -8.53 0.06 0
75170 48423121 1 N2O2C17H34 A2B2C17D34 -113.03 2.61 -8.53 1.13 0
75171 48423122 2 NOC9H17 ABC9D17 -107.63 3.57 -8.54 1.26 0
75172 48423123 1 N3O3C20H31 A3B3C20D31 -134.26 3.3 -8.81 0.11 0
75173 48423124 2 NOC8H15 ABC8D15 -101.96 3.33 -8.54 1.08 0
75174 48423125 3 NOC7H11 ABC7D11 -140.31 3.47 -8.71 0.07 0
75175 48423126 1 N2O2C17H32 A2B2C17D32 -101.92 4.38 -8.55 0.98 0
75176 48423127 1 N3O3C20H33 A3B3C20D33 -137.72 3.31 -8.77 0.25 0
75177 48423128 2 NOC8H16 ABC8D16 -101.75 3.43 -8.86 0.88 0
75178 48423129 1 N2O2C15H30 A2B2C15D30 -98.8 4.92 -8.85 0.96 0
75179 48423130 1 O3N4C21H34 A3B4C21D34 -126.34 1.7 -8.26 0.14 0
75180 48423131 1 O2N3C17H33 A2B3C17D33 -92.53 3.31 -8.61 1.1 0
75181 48423132 1 N3O3C19H31 A3B3C19D31 -137.97 3.58 -8.41 0.08 0
75182 48423133 1 O3N4C19H30 A3B4C19D30 -119.4 3.3 -8.54 0.31 0
75183 48423134 1 O2N3C15H29 A2B3C15D29 -85.8 3.45 -8.26 1.06 0
75184 48423135 1 O3N4C21H34 A3B4C21D34 -123.8 2.12 -8.51 0.28 0
75185 48423136 1 O2N3C17H33 A2B3C17D33 -93.18 2.56 -8.43 1.09 0
75186 48423138 1 NO2C17H25 AB2C17D25 -69.61 2.93 -9.26 0.16 0
75187 48423139 1 BrNO2C17H22 ABC2D17E22 -33.4 4.68 -8.95 -0.22 0
75188 48423140 1 BrFNO2C14H17 ABCD2E14F17 -99.94 2.71 -9.79 -0.65 0
75189 48423141 1 N2O4C21H26 A2B4C21D26 -133.36 1.65 -8.94 0.15 0
75190 48423145 1 O2N3C21H33 A2B3C21D33 -65.83 3.8 -7.99 0.72 0
75191 48423146 1 N4O4C21H32 A4B4C21D32 -178.93 4.93 -8.76 0.21 0
75192 48423152 1 N2O3C15H30 A2B3C15D30 -126.82 2.93 -8.86 0.86 0
75193 48423154 1 N2O4C19H22 A2B4C19D22 -132.7 2.43 -8.78 -0.18 0
75194 48423155 2 NOC9H14 ABC9D14 -58.4 4.03 -8.21 0.33 0
75195 48423157 1 F2N2O3C19H20 A2B2C3D19E20 -190.83 2.2 -9.5 -0.58 0
75196 48423158 1 N3O3C23H29 A3B3C23D29 -99.87 2.25 -8.76 0.11 0
75197 48423163 1 N2O3C18H26 A2B3C18D26 -133.92 3.02 -9.33 0.35 0
75198 48423164 1 O2N3C21H33 A2B3C21D33 -67.19 3.11 -8.12 0.46 0
75199 48423165 1 FNO2C14H18 ABC2D14E18 -100.96 2.32 -9.58 -0.34 0
75200 48423166 1 NF2O2C15H19 AB2C2D15E19 -157.07 3.17 -9.78 -0.56 0
75201 48423167 1 ClNO2C16H22 ABC2D16E22 -68.85 4.19 -9.32 -0.2 0
75202 48423168 1 N2O3C18H26 A2B3C18D26 -91.55 3.42 -8.34 0.37 0
75203 48423169 1 N3O3C24H29 A3B3C24D29 -71.66 2.31 -9.0 -0.08 0
75204 48423170 2 NOC10H14 ABC10D14 -35.2 3.97 -8.74 0.21 0
75205 48423172 1 N2O5C20H24 A2B5C20D24 -159.56 3.6 -8.9 0.14 0
75206 48423173 1 N2O2C19H28 A2B2C19D28 -61.65 2.4 -8.93 0.3 0
75207 48423174 1 O2N3C20H31 A2B3C20D31 -51.9 3.79 -8.68 0.41 0
75208 48423175 1 SO2N3C19H25 AB2C3D19E25 -14.64 3.99 -8.94 -0.82 0
75209 48423176 1 N3O3C23H29 A3B3C23D29 -94.22 6.2 -8.98 -0.01 0
75210 48423177 1 N2O2C19H28 A2B2C19D28 -61.04 3.38 -8.75 0.35 0
75211 48423178 1 NO4C18H25 AB4C18D25 -131.93 4.1 -8.92 -0.03 0
75212 48423179 1 N2O3C19H28 A2B3C19D28 -96.23 3.43 -9.12 0.29 0
75213 48423180 1 NSO4C22H27 ABC4D22E27 -99.56 1.99 -8.3 -0.13 0
75214 48423181 1 NO4C19H27 AB4C19D27 -136.14 4.66 -8.65 0.2 0
75215 48423182 1 N3O4C17H19 A3B4C17D19 -109.03 2.81 -8.98 -0.56 0
75216 48423183 1 N3O4C23H29 A3B4C23D29 -129.41 3.4 -9.06 0.24 0
75217 48423184 1 O2F3N3C17H22 A2B3C3D17E22 -205.82 3.37 -9.08 -0.7 0
75218 48423185 1 FN2O3C18H19 AB2C3D18E19 -139.87 4.07 -9.65 -0.09 0
75219 48423186 1 N3O4C22H27 A3B4C22D27 -122.66 0.93 -8.29 0.22 0
75220 48423188 1 O2N3C12H19 A2B3C12D19 -44.96 6.41 -9.29 0.54 0
75221 48423189 1 O3N4C19H20 A3B4C19D20 -58.19 2.85 -8.93 -0.56 0
75222 48423190 1 O2N3C15H19 A2B3C15D19 -24.4 1.39 -8.93 -0.56 0
75223 48423192 1 NO2C17H25 AB2C17D25 -71.1 2.56 -9.45 0.23 0
75224 48423193 1 O3N5C19H21 A3B5C19D21 -45.13 4.32 -9.15 -0.73 0
75225 48423194 2 NO2C11H14 AB2C11D14 -151.77 1.52 -8.53 0.19 0
75226 48423195 1 NO2C13H25 AB2C13D25 -105.53 2.31 -9.33 0.91 0
75227 48423196 1 N2O3C21H26 A2B3C21D26 -106.96 2.39 -9.32 0.08 0
75228 48423197 1 N4O4C21H32 A4B4C21D32 -173.83 5.18 -9.07 0.01 0
75229 48423198 1 N3O3C17H31 A3B3C17D31 -130.78 5.96 -9.08 0.74 0
75230 48423199 1 O2N4C15H20 A2B4C15D20 -11.13 7.45 -9.19 -0.81 0
75231 48423200 1 NO3C18H27 AB3C18D27 -118.04 1.82 -8.53 0.35 0
75232 48423201 1 N2O2C19H30 A2B2C19D30 -74.57 4.35 -8.92 0.25 0
75233 48423205 1 O2F3N3C18H24 A2B3C3D18E24 -209.9 6.78 -8.93 -0.44 0
75234 48423209 1 N2O3C19H28 A2B3C19D28 -91.19 2.33 -9.07 0.1 0
75235 48423213 1 O2N3C20H27 A2B3C20D27 -24.79 3.96 -8.98 -0.76 0
75236 48423214 1 N3O3C23H31 A3B3C23D31 -105.11 1.92 -8.55 -0.07 0
75237 48423217 1 O2N4C19H30 A2B4C19D30 -61.71 4.05 -8.86 0.07 0
75238 48423218 1 N3O3C24H31 A3B3C24D31 -99.94 3.12 -8.11 0.35 0
75239 48423220 2 NO3C10H12 AB3C10D12 -216.35 2.31 -9.48 -0.25 0
75240 48423221 1 O3N5C22H25 A3B5C22D25 -46.0 7.62 -9.26 -0.92 0
75241 48423222 2 ON2C9H12 AB2C9D12 -12.45 4.88 -9.07 -0.7 0
75242 48423224 1 N3O3C17H29 A3B3C17D29 -94.6 4.74 -9.18 0.65 0
75243 48423225 1 N3O3C20H25 A3B3C20D25 -89.46 3.04 -8.74 -0.01 0
75244 48423226 1 N4O5C21H30 A4B5C21D30 -193.04 4.83 -9.13 0.05 0
75245 48423227 1 N3O4C17H29 A3B4C17D29 -159.19 1.65 -9.16 0.57 0
75246 48423231 1 SN2O3C15H18 AB2C3D15E18 -52.22 3.43 -9.22 -0.95 0
75247 48423232 1 N3O5C21H29 A3B5C21D29 -205.74 3.2 -9.4 0.06 0
75248 48423233 2 NOC9H13 ABC9D13 -61.04 2.85 -8.71 0.14 0
75249 48423236 2 NO2C10H12 AB2C10D12 -90.14 7.16 -8.3 -0.11 0
75250 48423238 1 NO2C14H23 AB2C14D23 -54.3 2.94 -9.67 1.07 0
75251 48423239 1 N2O4C17H28 A2B4C17D28 -166.75 3.92 -9.45 0.43 0