List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
331981 127250267 1 OSN3C22H25 ABC3D22E25 30.47 3.57 -9.04 -0.39 0
331982 127250268 1 SO2N3C23H27 AB2C3D23E27 -7.9 2.48 -8.62 -0.18 0
331983 127250269 1 FN4O4C23H25 AB4C4D23E25 -171.64 5.73 -9.35 -0.4 0
331984 127250270 1 FO3N4C24H27 AB3C4D24E27 -60.95 3.09 -8.93 -0.35 0
331985 127250271 1 FN2O2C23H23 AB2C2D23E23 -42.44 3.46 -8.97 -0.42 0
331986 127250272 1 FN2O2C23H23 AB2C2D23E23 -45.98 4.28 -8.93 -0.46 0
331987 127250273 1 ClN2O2H19C22 AB2C2D19E22 -5.98 4.25 -9.42 -0.55 0
331988 127250274 1 N3O3H21C23 A3B3C21D23 -38.36 5.3 -9.32 -0.68 0
331989 127250275 2 NOC12H13 ABC12D13 -4.01 2.0 -8.86 -0.31 0
331990 127250276 1 ON4C21H22 AB4C21D22 55.44 2.33 -8.9 -1.02 0
331991 127250277 1 ON4C20H22 AB4C20D22 51.63 2.45 -8.94 -0.66 0
331992 127250278 1 O3N4C24H30 A3B4C24D30 -84.74 8.76 -9.0 -0.62 0
331993 127250279 1 N4O4C23H28 A4B4C23D28 -114.04 7.44 -8.98 -0.66 0
331994 127250280 1 FN2O2C23H23 AB2C2D23E23 -47.14 1.27 -8.72 -0.47 0
331995 127250281 1 N2O2C21H28 A2B2C21D28 -49.31 1.96 -8.57 -0.41 0
331996 127250282 1 N3O3C20H23 A3B3C20D23 -85.13 3.66 -9.34 -0.68 0
331997 127250283 1 N3O3C24H29 A3B3C24D29 -97.32 4.24 -9.35 -0.8 0
331998 127250284 1 O3N4H20C21 A3B4C20D21 -11.53 4.66 -9.23 -1.12 0
331999 127250285 1 O3N4H20C22 A3B4C20D22 -27.04 3.37 -9.26 -0.56 0
332000 127250286 1 O3N4C16H18 A3B4C16D18 -45.39 1.0 -9.49 -1.16 0
332001 127250287 1 O2N4C21H26 A2B4C21D26 -29.74 5.76 -9.43 -1.07 0
332002 127250288 1 O3N4C23H24 A3B4C23D24 -28.32 6.82 -8.78 -1.11 0
332003 127250289 1 O3N4C22H24 A3B4C22D24 -31.31 7.46 -8.92 -0.45 0
332004 127250290 1 O2N5H19C20 A2B5C19D20 24.7 3.17 -9.3 -1.06 0
332005 127250291 1 ClO3N4C23H27 AB3C4D23E27 -90.38 4.49 -9.07 -0.56 0
332006 127250292 1 ClFN2O2H20C23 ABC2D2E20F23 -63.8 1.34 -9.3 -0.76 0
332007 127250293 1 FN3O3H22C24 AB3C3D22E24 -95.85 4.95 -9.3 -0.71 0
332008 127250294 1 FO2N4H19C21 AB2C4D19E21 -31.29 2.87 -9.39 -1.15 0
332009 127250295 1 O2N4C19H22 A2B4C19D22 -18.58 5.74 -9.4 -1.09 0
332010 127250296 1 ClON4H17C19 ABC4D17E19 52.45 1.14 -8.86 -0.78 0
332011 127250297 1 O2N5H19C20 A2B5C19D20 19.96 2.21 -8.92 -0.83 0
332012 127250298 1 O2N5C22H23 A2B5C22D23 -2.0 4.96 -8.77 -0.5 0
332013 127250299 1 O2N5C22H23 A2B5C22D23 -2.42 3.88 -8.64 -0.83 0
332014 127250300 1 O3N4H24C26 A3B4C24D26 -30.81 6.64 -8.45 -0.67 0
332015 127250301 1 O2N5H21C23 A2B5C21D23 32.32 6.56 -8.64 -1.01 0
332016 127250302 1 O2N6H20C23 A2B6C20D23 49.16 3.52 -9.21 -0.97 0
332017 127250303 1 ClO2N4H19C21 AB2C4D19E21 8.6 4.66 -9.44 -1.0 0
332018 127250304 2 ON3C9H9 AB3C9D9 37.47 7.13 -9.17 -0.96 0
332019 127250305 1 ClON4C21H21 ABC4D21E21 28.71 2.48 -8.9 -0.8 0
332020 127250306 1 O2N5C22H23 A2B5C22D23 -3.68 1.74 -8.94 -0.92 0
332021 127250307 1 N3O3H23C26 A3B3C23D26 -7.66 6.01 -8.98 -1.16 0
332022 127250308 1 ClO2N3H20C25 AB2C3D20E25 20.67 3.82 -9.34 -1.12 0
332023 127250309 2 N2O2C11H13 A2B2C11D13 -110.45 3.54 -9.11 -0.9 0
332024 127250310 1 ClO2N3C21H24 AB2C3D21E24 -42.28 2.67 -9.18 -0.65 0
332025 127250311 1 O3N6H22C24 A3B6C22D24 15.8 1.55 -9.32 -0.89 0
332026 127250312 1 O3N5C24H25 A3B5C24D25 -36.73 5.03 -9.14 -0.68 0
332027 127250313 1 FO2N3H20C25 AB2C3D20E25 -14.01 2.65 -8.98 -0.95 0
332028 127250314 1 SO2N6C19H20 AB2C6D19E20 11.16 3.97 -9.14 -0.77 0
332029 127250315 1 FO2N4C22H23 AB2C4D22E23 -42.49 2.87 -9.45 -0.52 0
332030 127250316 2 ON2C11H13 AB2C11D13 6.79 3.76 -8.7 -0.41 0
332031 127250317 1 ClON4C21H23 ABC4D21E23 44.85 2.86 -8.69 -0.84 0
332032 127250318 1 ON6C19H22 AB6C19D22 70.38 3.52 -8.81 -0.99 0
332033 127250319 1 FON4C21H23 ABC4D21E23 2.36 2.49 -8.67 -0.51 0
332034 127250320 1 ClON4C21H23 ABC4D21E23 39.0 3.08 -8.75 -0.67 0
332035 127250321 1 FON3H22C25 ABC3D22E25 21.62 4.68 -8.77 -0.67 0
332036 127250322 1 O2N3H25C26 A2B3C25D26 28.45 3.55 -8.98 -0.63 0
332037 127250323 1 FON5C22H24 ABC5D22E24 13.07 1.22 -8.55 -0.46 0
332038 127250324 1 ClON5C22H24 ABC5D22E24 49.3 2.4 -8.68 -0.68 0
332039 127250325 1 O2N6C23H26 A2B6C23D26 17.56 4.43 -8.63 -0.68 0
332040 127250326 1 O3N4C24H24 A3B4C24D24 -1.48 5.23 -8.04 -1.1 0
332041 127250327 1 O3N4C23H24 A3B4C23D24 -4.71 5.04 -8.04 -0.77 0
332042 127250328 1 O3N4C25H26 A3B4C25D26 -17.36 2.48 -8.06 -0.51 0
332043 127250329 1 O3N4C26H26 A3B4C26D26 -36.01 4.43 -9.26 -0.7 0
332044 127250330 1 ClO2N5H22C24 AB2C5D22E24 23.72 5.66 -9.1 -0.85 0
332045 127250331 1 SO2N5H17C18 AB2C5D17E18 29.85 5.09 -9.52 -1.12 0
332046 127250332 1 O3N6C20H22 A3B6C20D22 9.47 5.52 -9.06 -0.66 0
332047 127250333 1 ClO2N6C19H19 AB2C6D19E19 40.88 6.63 -9.68 -0.93 0
332048 127250334 1 FN3O3H24C26 AB3C3D24E26 -73.98 5.45 -8.26 -0.53 0
332049 127250335 1 O3N4C25H32 A3B4C25D32 -90.02 7.0 -8.78 -0.6 0
332050 127250336 2 N2O2C11H11 A2B2C11D11 -84.16 4.28 -9.41 -0.87 0
332051 127250337 2 N2O2C11H11 A2B2C11D11 -83.2 5.95 -9.38 -0.86 0
332052 127250338 1 O3N5C19H19 A3B5C19D19 -18.45 6.0 -9.45 -1.1 0
332053 127250339 1 ON6C25H28 AB6C25D28 56.25 3.0 -8.78 -0.48 0
332054 127250340 1 ON6C25H26 AB6C25D26 92.36 1.12 -8.61 -1.19 0
332055 127250341 1 ON6C24H26 AB6C24D26 86.85 3.49 -8.72 -0.77 0