List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
83182 49857252 2 NH5C9 AB5C9 176.04 1.7 -9.42 -1.27 0
83183 49857253 1 ClO2C11H13 AB2C11D13 -85.79 4.78 -9.74 -0.41 0
83184 49857254 1 O5C17H22 A5B17C22 -166.44 2.59 -10.0 -0.77 0
83185 49857257 2 NO3C21H36 AB3C21D36 -294.51 6.89 -8.93 0.76 0
83186 49857258 2 NOC16H26 ABC16D26 -79.83 3.22 -9.02 -0.11 0
83187 49857259 2 NOC16H26 ABC16D26 -110.16 4.26 -8.77 0.65 0
83188 49857260 2 NOC15H24 ABC15D24 -117.21 3.32 -8.71 0.62 0
83189 49857262 1 O2C9H14 A2B9C14 -104.75 2.75 -10.23 0.26 0
83190 49857263 1 BrNO3C11H14 ABC3D11E14 -105.69 3.18 -10.17 -0.33 0
83191 49857264 1 ISi2O3C34H65 AB2C3D34E65 -276.55 2.98 -8.7 -0.56 0
83192 49857265 1 PO7C27H29 AB7C27D29 -279.69 3.44 -8.77 -0.21 0
83193 49857266 1 Si2O6C49H84 A2B6C49D84 -397.2 2.2 -8.54 0.16 0
83194 49857267 1 O6C31H44 A6B31C44 -248.63 3.12 -8.78 0.22 0
83195 49857268 1 O6C31H44 A6B31C44 -258.95 1.53 -8.76 0.23 0
83196 49857269 1 NSF3H6O6C13 ABC3D6E6F13 -239.27 3.96 -9.59 -2.17 0
83197 49857270 1 BNSO4C18H18 ABCD4E18F18 -129.28 8.11 -8.56 -1.31 0
83198 49857271 1 BNO5C18H18 ABC5D18E18 -155.68 7.57 -9.28 -1.55 0
83199 49857272 1 SN4O4H18C24 AB4C4D18E24 17.29 2.49 -8.9 -1.54 0
83200 49857273 1 SN3O4H19C25 AB3C4D19E25 10.01 2.33 -9.07 -1.73 0
83201 49857274 1 SO2N3H21C25 AB2C3D21E25 9.48 9.11 -8.49 -0.86 0
83202 49857275 1 O2C21H28 A2B21C28 -87.39 2.81 -8.34 -0.02 0
83203 49857278 1 O3C21H28 A3B21C28 -109.46 1.65 -7.96 0.0 0
83204 49857279 2 O2C11H14 A2B11C14 -136.12 2.86 -8.47 -0.74 0
83205 49857280 4 OC5H6 AB5C6 -146.23 5.96 -8.6 -0.94 0
83206 49857281 1 O4C19H24 A4B19C24 -158.58 7.37 -9.32 -1.44 0
83207 49857282 1 ClFSN6H16C17 ABCD6E16F17 57.82 3.9 -8.85 -0.79 0
83208 49857283 1 ClFON8C22H26 ABCD8E22F26 16.8 4.44 -8.81 -0.77 0
83209 49857284 2 FN2H8C9 AB2C8D9 -7.34 2.97 -8.89 -0.34 0
83210 49857286 1 ON3C12H13 AB3C12D13 18.43 1.58 -8.97 -0.32 0
83211 49857287 2 N2C9H9 A2B9C9 91.3 1.7 -8.41 -0.36 0
83212 49857288 1 FN4H17C18 AB4C17D18 46.7 2.4 -8.59 -0.41 0
83213 49857289 1 N5C17H17 A5B17C17 99.15 0.96 -8.67 -0.41 0
83214 49857291 1 BClN3O4C20H25 ABC3D4E20F25 -221.71 5.54 -9.64 -0.66 0
83215 49857292 1 BClN3O4C20H25 ABC3D4E20F25 -222.4 2.93 -9.7 -0.72 0
83216 49857294 1 BN3O5C21H28 AB3C5D21E28 -253.89 6.09 -9.26 -0.58 0
83217 49857297 1 NO3C22H25 AB3C22D25 -115.47 2.85 -9.14 0.02 0
83218 49857298 1 FN3O3H14C15 AB3C3D14E15 -107.34 5.3 -10.04 -1.41 0
83219 49857300 1 NO5C16H23 AB5C16D23 -217.13 3.86 -9.27 -0.24 0
83220 49857301 1 FNO3C17H22 ABC3D17E22 -183.11 5.19 -9.94 -0.38 0
83221 49857302 1 BClN2O4C35H40 ABC2D4E35F40 -202.34 2.34 -9.07 -0.4 0
83222 49857303 1 BClFN2O4C34H37 ABCD2E4F34G37 -240.78 0.91 -9.49 -0.45 0
83223 49857304 1 BClN2O4C34H44 ABC2D4E34F44 -123.88 4.52 -6.17 -0.82 0
83224 49857307 1 SiO2C23H46 AB2C23D46 -229.04 1.49 -8.72 1.4 0
83225 49857308 1 SiO2C23H46 AB2C23D46 -229.48 2.35 -8.73 1.38 0
83226 49857312 1 SiO2C23H44 AB2C23D44 -216.03 3.1 -8.77 0.85 0
83227 49857313 1 O2N5F6H17C19 A2B5C6D17E19 -280.66 2.14 -9.39 -1.39 0
83228 49857314 1 O3N5C23H23 A3B5C23D23 34.26 5.83 -9.05 -0.87 0
83229 49857315 1 O2N5C23H23 A2B5C23D23 63.6 7.15 -9.14 -0.78 0
83230 49857316 2 ON3C10H10 AB3C10D10 68.84 7.28 -9.22 -0.89 0
83231 49857319 1 F2N2H12C19 A2B2C12D19 45.86 5.04 -8.52 -0.99 0
83232 49857320 1 ON2H16C20 AB2C16D20 99.38 2.12 -8.88 -0.66 0
83233 49857321 1 ON2H16C20 AB2C16D20 98.88 2.51 -8.08 -0.78 0
83234 49857326 2 NOC9H9 ABC9D9 0.07 2.84 -8.69 -0.8 0
83235 49857329 1 O2N7H21C23 A2B7C21D23 97.7 6.15 -8.75 -0.55 0
83236 49857330 1 ON7C21H21 AB7C21D21 56.66 1.77 -8.39 -0.38 0
83237 49857332 1 O3N5H21C22 A3B5C21D22 -41.95 8.79 -9.79 -0.62 0
83238 49857333 2 OC7H8 AB7C8 -42.19 0.61 -8.06 -0.4 0
83239 49857335 1 FOC13H13 ABC13D13 -53.42 3.31 -8.67 -0.49 0
83240 49857337 1 O2C15H16 A2B15C16 -49.87 1.8 -8.32 -0.43 0
83241 49857339 1 NO2C18H23 AB2C18D23 -50.64 1.31 -8.39 -0.35 0
83242 49857341 1 N3O3H19C21 A3B3C19D21 -32.38 3.79 -8.99 -0.43 0
83243 49857342 1 SN5O9C40H47 AB5C9D40E47 -278.36 4.9 -9.07 -1.06 0
83244 49857343 1 SF2N5O9C39H45 AB2C5D9E39F45 -395.21 4.19 -9.12 -0.94 0
83245 49857346 1 SN5O9C40H49 AB5C9D40E49 -308.14 7.52 -8.84 -0.83 0
83246 49857349 2 O5N9C25H37 A5B9C25D37 -379.82 8.89 -8.36 -0.14 0
83251 49857354 1 OPN2H30C39 ABC2D30E39 164.82 5.07 0.0 0.0 0
83252 49857355 1 BClO2C12H24 ABC2D12E24 -221.69 3.96 -10.02 0.91 0
83253 49857356 1 BClFO2C14H19 ABCD2E14F19 -219.41 2.84 -9.32 -0.15 0
83254 49857357 1 BClO2C11H20 ABC2D11E20 -190.91 3.97 -9.37 0.45 0
83255 49857358 1 BClO2C12H22 ABC2D12E22 -196.24 4.07 -9.38 0.47 0
83256 49857359 1 ON7C25H27 AB7C25D27 64.6 4.17 -8.8 -0.9 0
83257 49857360 1 N8O10C39H48 A8B10C39D48 -310.01 5.04 -9.0 -0.91 0
83258 49857361 1 O7N9C37H47 A7B9C37D47 -204.43 5.67 -8.34 -0.56 0
83259 49857363 1 N6O14C85H164 A6B14C85D164 -880.19 5.44 -9.37 0.08 0
83260 49857365 1 NO6C9H17 AB6C9D17 -287.24 3.47 -10.14 0.08 0
83261 49857366 1 NSO7C8H17 ABC7D8E17 -324.2 2.58 -10.08 0.1 0
83262 49857368 1 O5N8C42H42 A5B8C42D42 -56.65 7.1 -8.63 -0.61 0
83263 49857369 1 O6N9C49H55 A6B9C49D55 -146.4 2.85 -8.65 -0.42 0
83264 49857370 1 O4N10C43H46 A4B10C43D46 -9.75 3.79 -8.59 -0.47 0
83265 49857371 1 O2S2N5C21H23 A2B2C5D21E23 28.71 6.59 -8.54 -0.76 0
83266 49857372 1 O3N5C21H27 A3B5C21D27 -80.44 2.47 -8.62 -0.53 0
83267 49857373 1 O3N5C21H27 A3B5C21D27 -82.09 4.21 -8.7 -0.65 0
83268 49857374 1 O3N5C21H25 A3B5C21D25 -63.34 3.37 -8.72 -0.75 0
83269 49857375 1 O3N5C21H25 A3B5C21D25 -61.95 3.68 -8.67 -0.63 0
83270 49857376 1 O3N5C23H29 A3B5C23D29 -72.25 5.4 -8.73 -0.71 0
83271 49857377 1 O3N5C21H25 A3B5C21D25 -59.88 4.2 -8.6 -0.51 0
83272 49857378 1 N2O23C60H110 A2B23C60D110 -1168.09 5.19 -9.71 0.13 0
83273 49857381 1 SO5C10H10 AB5C10D10 -165.98 6.07 -9.4 -0.88 0
83276 49857388 1 OF4N6H26C28 AB4C6D26E28 -85.41 4.84 -9.25 -1.11 0
83277 49857389 1 OF2N6C29H30 AB2C6D29E30 3.37 4.44 -9.17 -1.05 0
83278 49857391 1 O3F5N6H29C31 A3B5C6D29E31 -200.44 5.2 -9.2 -1.07 0
83279 49857392 1 OF2N6H28C29 AB2C6D28E29 33.22 3.95 -9.22 -1.09 0
83280 49857394 1 FSO2N5H18C22 ABC2D5E18F22 22.12 5.7 -9.08 -1.56 0
83281 49857395 1 SO2N6H18C21 AB2C6D18E21 84.47 7.38 -8.67 -1.38 0
83282 49857397 1 SO2N6H20C23 AB2C6D20E23 88.01 6.54 -9.04 -1.56 0
83283 49857399 1 F2S2O3N4C18H20 A2B2C3D4E18F20 -183.56 6.11 -9.16 -1.2 0
83284 49857400 1 FS2O4N5C22H30 AB2C4D5E22F30 -200.95 9.26 -9.21 -0.72 0
83285 49857401 1 FS2O4N5C23H32 AB2C4D5E23F32 -207.75 7.25 -9.05 -1.3 0
83286 49857403 1 S2O4N5C22H31 A2B4C5D22E31 -161.34 7.74 -8.88 -1.05 0
83287 49857404 1 SO2N5C18H21 AB2C5D18E21 -4.62 5.02 -9.27 -1.28 0