List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
68251 46508052 1 N3O4C20H25 A3B4C20D25 -109.14 6.44 -8.18 -0.56 0
68252 46508054 1 N5O5C21H21 A5B5C21D21 -58.05 9.16 -8.65 -1.84 0
68253 46508055 1 SO3N4H16C18 AB3C4D16E18 -3.02 3.5 -8.39 -1.04 0
68254 46508056 1 SF3O3N5C17H18 AB3C3D5E17F18 -225.08 5.1 -9.19 -0.99 0
68255 46508059 1 SN4O4C20H32 AB4C4D20E32 -186.66 5.35 -9.28 -0.6 0
68256 46508060 1 SO4N5H21C25 AB4C5D21E25 8.3 6.31 -9.06 -1.75 0
68257 46508063 1 F2N2O4H20C23 A2B2C4D20E23 -180.67 6.42 -9.02 -1.2 0
68258 46508064 1 ClN3O3C19H22 AB3C3D19E22 -74.27 5.58 -9.44 -0.74 0
68259 46508073 1 ClS2O3N4C20H21 AB2C3D4E20F21 -105.32 1.72 -8.67 -1.16 0
68260 46508074 1 N2O6C19H20 A2B6C19D20 -159.98 2.52 -8.79 -0.52 0
68261 46508075 2 NO3H8C9 AB3C8D9 -150.07 2.73 -8.94 -0.86 0
68262 46508076 1 ClSN3O3H16C20 ABC3D3E16F20 -22.27 5.77 -8.79 -1.33 0
68263 46508077 1 ClSN2F3O3H8C15 ABC2D3E3F8G15 -159.19 2.13 -9.78 -1.45 0
68264 46508078 1 ON4H16C20 AB4C16D20 79.1 2.85 -9.02 -0.81 0
68265 46508079 1 NOSH17C19 ABCD17E19 34.03 3.0 -8.98 -0.58 0
68266 46508082 1 IO3N4H15C18 AB3C4D15E18 -4.97 2.26 -9.2 -1.5 0
68267 46508083 1 O2N4H26C27 A2B4C26D27 33.91 3.43 -8.89 -1.14 0
68268 46508087 1 N2O5H22C23 A2B5C22D23 -114.96 2.64 -8.88 -0.7 0
68269 46508088 1 O4N6C19H24 A4B6C19D24 -80.13 6.16 -9.07 -0.74 0
68270 46508089 1 O2S3N4C14H14 A2B3C4D14E14 -19.33 5.75 -8.86 -1.04 0
68271 46508091 1 FO3N5C24H28 AB3C5D24E28 -107.48 6.28 -8.86 -0.57 0
68272 46508092 1 Cl3N3O3H14C19 A3B3C3D14E19 -62.26 3.32 -9.07 -1.07 0
68273 46508093 1 N3O3C22H23 A3B3C22D23 -52.83 2.96 -9.01 -0.97 0
68274 46508094 1 N3O5C21H21 A3B5C21D21 -125.0 3.58 -8.88 -1.02 0
68275 46508096 2 N2O2H9C11 A2B2C9D11 -76.08 10.43 -8.86 -0.95 0
68276 46508098 1 OSN4C20H20 ABC4D20E20 57.87 5.15 -8.59 -0.82 0
68277 46508099 1 SO3N5H17C19 AB3C5D17E19 -3.04 6.16 -8.7 -0.87 0
68278 46508100 1 ClSN2O6C23H23 ABC2D6E23F23 -153.81 6.52 -9.42 -0.72 0
68279 46508104 1 SN2O3C19H28 AB2C3D19E28 -136.55 10.07 -9.39 -0.39 0
68280 46508106 1 FN2O6H25C27 AB2C6D25E27 -231.4 2.45 -8.74 -0.68 0
68281 46508111 1 FOSN4H13C18 ABCD4E13F18 24.46 2.66 -8.9 -0.99 0
68282 46508112 1 O2F3N3H16C17 A2B3C3D16E17 -207.54 6.71 -9.26 -0.48 0
68283 46508113 1 SO2F3N5C22H28 AB2C3D5E22F28 -193.02 8.69 -9.08 -0.7 0
68284 46508115 1 N3O4H17C19 A3B4C17D19 -36.22 8.26 -10.04 -1.32 0
68285 46508116 1 N2O3H16C21 A2B3C16D21 -8.46 3.31 -8.79 -1.0 0
68286 46508118 1 SO2N3C26H31 AB2C3D26E31 -35.62 4.83 -8.83 -0.53 0
68287 46508119 1 SN3O4C24H27 AB3C4D24E27 -97.15 7.25 -8.71 -0.55 0
68288 46508120 1 SN3O3H23C24 AB3C3D23E24 -36.01 6.63 -8.63 -0.6 0
68289 46508121 1 SCl2N4O4C18H26 AB2C4D4E18F26 -170.42 2.41 -8.88 -1.12 0
68290 46508122 1 SO3N5H15C17 AB3C5D15E17 49.67 2.07 -8.97 -1.35 0
68291 46508126 1 ClSO2N5C23H26 ABC2D5E23F26 -24.37 5.92 -9.26 -0.76 0
68292 46508127 1 ClSN4O4C18H19 ABC4D4E18F19 -86.93 6.55 -9.2 -1.28 0
68293 46508129 1 SF3O3N4C20H21 AB3C3D4E20F21 -207.49 6.34 -9.49 -0.92 0
68294 46508131 1 N3O4H23C24 A3B4C23D24 -33.62 2.91 -8.4 -1.23 0
68295 46508132 1 N2F3O6H17C21 A2B3C6D17E21 -288.56 7.13 -8.88 -1.54 0
68296 46508133 1 FOSN2H17C18 ABCD2E17F18 -12.97 0.7 -9.39 -1.65 0
68297 46508134 1 NSO5C21H23 ABC5D21E23 -172.66 6.67 -8.71 -0.74 0
68298 46508135 1 N3O4C16H29 A3B4C16D29 -218.59 4.53 -9.31 0.28 0
68299 46508136 1 ClN2O3H17C18 AB2C3D17E18 -85.06 2.61 -8.89 -0.34 0
68300 46508137 1 SN4O5C21H24 AB4C5D21E24 -60.07 7.06 -9.34 -1.74 0
68301 46508142 1 SO2N5C17H17 AB2C5D17E17 45.87 4.53 -9.04 -0.59 0
68302 46508147 1 O3N5H17C20 A3B5C17D20 -5.87 2.26 -9.18 -1.1 0
68303 46508149 1 ON5C12H19 AB5C12D19 16.88 9.37 -10.52 -0.6 0
68304 46508150 1 NF2O6C16H17 AB2C6D16E17 -344.03 5.5 -9.2 -0.83 0
68305 46508152 1 SO2N3C24H25 AB2C3D24E25 18.0 5.04 -8.6 -0.58 0
68306 46508156 1 SN3O4H19C23 AB3C4D19E23 -73.88 4.32 -9.12 -1.1 0
68307 46508158 1 SO3N6C24H28 AB3C6D24E28 -41.6 1.67 -9.07 -1.11 0
68308 46508162 1 O4N5H23C26 A4B5C23D26 -0.93 5.03 -8.93 -0.94 0
68309 46508165 1 NSO4C18H21 ABC4D18E21 -148.81 4.83 -8.9 -0.64 0
68310 46508166 1 ClN3O3H20C21 AB3C3D20E21 -59.72 6.16 -8.83 -0.63 0
68311 46508167 1 SO2F3N3H10C18 AB2C3D3E10F18 -119.35 7.57 -9.35 -2.03 0
68312 46508170 1 N2Cl3F3O3H12C17 A2B3C3D3E12F17 -263.45 5.83 -9.0 -0.95 0
68313 46508172 1 SF3N3O5C20H24 AB3C3D5E20F24 -322.14 8.0 -8.99 -1.11 0
68314 46508174 1 F3O3N5H18C19 A3B3C5D18E19 -191.96 8.43 -9.28 -0.94 0
68315 46508175 1 N3O4C21H21 A3B4C21D21 -75.91 6.18 -8.37 -1.19 0
68316 46508177 1 N5O6C22H23 A5B6C22D23 -100.17 9.12 -9.03 -1.8 0
68317 46508178 1 SN2O6C19H26 AB2C6D19E26 -247.61 6.05 -9.25 -0.63 0
68318 46508181 1 O2F3N4C25H25 A2B3C4D25E25 -174.64 6.25 -9.44 -0.87 0
68319 46508182 1 BrN3O3H18C19 AB3C3D18E19 -82.22 0.6 -8.97 -0.34 0
68320 46508185 1 S2O3N4H16C17 A2B3C4D16E17 -12.31 6.74 -9.01 -1.01 0
68321 46508186 1 ClN4O4C17H17 AB4C4D17E17 -120.44 4.38 -9.45 -0.86 0
68322 46508187 1 SN4O5C20H22 AB4C5D20E22 -179.09 3.64 -8.52 -0.62 0
68323 46508190 1 SN2O2F3H13C18 AB2C2D3E13F18 -141.4 3.27 -9.14 -1.12 0
68324 46508191 1 ClFSN2O3H16C19 ABCD2E3F16G19 -96.09 5.75 -8.4 -1.14 0
68325 46508192 1 FSN2O2C21H21 ABC2D2E21F21 -59.74 2.48 -8.89 -0.85 0
68326 46508193 1 N2O2F3H13C15 A2B2C3D13E15 -194.89 2.24 -8.94 -0.98 0
68327 46508195 1 SO2N4H22C23 AB2C4D22E23 18.27 1.99 -8.53 -0.67 0
68328 46508197 1 O2F4N4H14C17 A2B4C4D14E17 -194.62 10.19 -10.16 -1.49 0
68329 46508198 1 F3O3N4H19C20 A3B3C4D19E20 -196.31 11.43 -9.63 -1.32 0
68330 46508199 1 FSN2O4H23C26 ABC2D4E23F26 -119.99 6.17 -9.24 -1.22 0
68331 46508202 1 N2S2O4H24C25 A2B2C4D24E25 -102.52 5.3 -8.29 -1.24 0
68332 46508205 1 SN2F3O5H17C18 AB2C3D5E17F18 -333.42 8.99 -9.21 -0.75 0
68333 46508206 1 N3O3H21C22 A3B3C21D22 -55.67 4.94 -8.47 -0.51 0
68334 46508208 1 F3O4N6H21C22 A3B4C6D21E22 -176.51 11.67 -9.25 -1.35 0
68335 46508210 1 F3O3N5C20H20 A3B3C5D20E20 -186.72 10.18 -9.62 -1.2 0
68336 46508217 1 SN2O4C21H22 AB2C4D21E22 -100.98 5.92 -8.68 -0.94 0
68337 46508218 1 FO2N3C14H20 AB2C3D14E20 -136.77 4.13 -8.51 -0.07 0
68338 46508219 1 N2S2O3C22H22 A2B2C3D22E22 -63.71 5.29 -8.68 -0.94 0
68339 46508220 1 N2S2O3H20C24 A2B2C3D20E24 -27.72 6.26 -8.6 -1.03 0
68340 46508221 1 F2N2S2O3H16C20 A2B2C2D3E16F20 -137.4 6.46 -9.04 -1.2 0
68341 46508222 1 Cl2N2S2O3H16C20 A2B2C2D3E16F20 -65.43 4.04 -8.69 -0.77 0
68342 46508223 1 BrN2O4C20H21 AB2C4D20E21 -122.95 5.72 -8.67 -0.33 0
68343 46508225 1 ClF3O4N5H17C19 AB3C4D5E17F19 -231.29 8.06 -9.05 -1.43 0
68344 46508226 1 F3N5O5C20H20 A3B5C5D20E20 -268.22 12.36 -9.17 -1.39 0
68345 46508227 1 F3O3N5H16C19 A3B3C5D16E19 -156.27 10.69 -9.57 -1.7 0
68346 46508228 1 F3O3N5H22C24 A3B3C5D22E24 -178.77 7.8 -9.05 -1.65 0
68347 46508229 1 ClNSO5C19H20 ABCD5E19F20 -175.82 5.11 -8.98 -0.39 0
68348 46508233 1 OSCl4N5H13C15 ABC4D5E13F15 5.92 3.29 -8.84 -1.29 0
68349 46508234 1 O3F4N4H16C18 A3B4C4D16E18 -229.54 5.99 -9.32 -1.6 0
68350 46508235 1 F3O3N5C22H24 A3B3C5D22E24 -202.92 12.12 -9.91 -1.14 0