List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
375343 131500019 1 BrNO3H8C10 ABC3D8E10 -53.1 4.51 -9.71 -1.01 0
375344 131500022 1 BrNO3H8C10 ABC3D8E10 -60.97 2.97 -9.86 -1.28 0
375345 131500025 1 BrClOC12H14 ABCD12E14 -46.97 3.92 -9.77 -0.88 0
375346 131500036 1 BrOC12H15 ABC12D15 -43.71 4.45 -9.28 -0.05 0
375347 131500039 1 BrOC12H15 ABC12D15 -45.95 3.1 -9.38 -0.73 0
375348 131500048 1 NO2C12H17 AB2C12D17 -74.79 3.03 -8.48 0.42 0
375349 131500050 1 BrNO2C11H12 ABC2D11E12 -68.48 5.94 -9.72 -0.8 0
375350 131500057 1 N2O3C10H12 A2B3C10D12 -92.08 4.87 -8.66 -0.32 0
375351 131500061 2 NOC5H6 ABC5D6 -37.12 3.33 -9.95 -0.8 0
375352 131500062 2 NOC5H6 ABC5D6 -40.05 3.73 -9.83 -0.58 0
375353 131500064 1 NO4C9H13 AB4C9D13 -155.89 3.03 -8.85 -0.18 0
375354 131500065 1 ON4C10H10 AB4C10D10 60.08 5.82 -9.73 -1.11 0
375355 131500067 1 ClNO3C9H12 ABC3D9E12 -121.98 3.26 -9.1 -0.27 0
375356 131500070 1 N2O3C9H10 A2B3C9D10 -59.03 6.45 -10.38 -0.76 0
375357 131500072 1 NO5C9H9 AB5C9D9 -99.22 3.12 -9.42 -1.64 0
375358 131500075 1 NO5H7C10 AB5C7D10 -80.89 2.96 -10.26 -2.2 0
375359 131500076 1 NOSC11H13 ABCD11E13 -5.39 5.47 -8.57 -0.85 0
375360 131500079 1 NOSC11H13 ABCD11E13 -6.09 2.06 -8.27 0.22 0
375361 131500082 1 N3H9C10 A3B9C10 64.46 3.87 -8.42 -0.63 0
375362 131500086 1 NSF3C10H10 ABC3D10E10 -125.06 3.32 -9.57 -1.22 0
375363 131500087 1 NOF2C11H13 ABC2D11E13 -116.66 4.47 -9.01 -0.48 0
375364 131500100 1 BrN2O3C9H11 AB2C3D9E11 -101.48 1.81 -10.11 -1.6 0
375365 131500101 1 NO3C11H15 AB3C11D15 -119.31 1.88 -8.96 0.07 0
375366 131500102 1 ClNC13H18 ABC13D18 -1.0 1.65 -9.18 0.01 0
375367 131500110 2 NOF2H2C4 ABC2D2E4 -220.47 5.32 -10.28 -1.51 0
375368 131500112 2 NOF2H2C4 ABC2D2E4 -226.13 4.99 -9.99 -1.34 0
375369 131500115 2 NOF2H2C4 ABC2D2E4 -239.62 3.55 -9.96 -1.32 0
375370 131500120 2 NOF2H2C4 ABC2D2E4 -225.21 4.63 -9.98 -1.42 0
375371 131500121 2 NOF2H2C4 ABC2D2E4 -226.62 5.33 -9.85 -1.41 0
375372 131500124 2 NOF2H2C4 ABC2D2E4 -233.8 2.97 -10.0 -1.55 0
375373 131500125 1 BrClNSO2F3H4C7 ABCDE2F3G4H7 -212.09 9.38 -9.58 -1.63 0
375374 131500132 1 ON4C9H12 AB4C9D12 61.95 6.03 -8.59 -0.9 0
375375 131500133 1 ON4C9H12 AB4C9D12 44.19 2.78 -9.48 -0.73 0
375376 131500136 1 ON4C9H12 AB4C9D12 47.23 4.37 -9.25 -0.85 0
375377 131500142 1 BrFNSH7C11 ABCDE7F11 18.18 2.69 -9.1 -1.3 0
375378 131500143 1 BrFNSH7C11 ABCDE7F11 16.93 3.02 -9.13 -1.36 0
375379 131500144 1 BrFNSH7C11 ABCDE7F11 17.16 3.28 -9.02 -1.3 0
375380 131500145 1 BrFNSH7C11 ABCDE7F11 17.13 3.68 -8.99 -1.23 0
375381 131500146 1 BrFNSH7C11 ABCDE7F11 17.05 3.55 -9.08 -1.33 0
375382 131500148 1 O2N5C9H15 A2B5C9D15 -30.35 3.85 -9.64 0.15 0
375383 131500151 1 BrSO3H9C11 ABC3D9E11 -91.95 3.42 -8.8 -1.39 0
375384 131500155 1 NO2C12H19 AB2C12D19 -98.2 3.09 -9.08 0.18 0
375385 131500161 1 ON3C10H11 AB3C10D11 19.55 3.9 -9.01 -0.42 0
375386 131500165 1 N2O3C10H14 A2B3C10D14 -53.61 5.4 -9.32 -1.5 0
375387 131500172 1 INOC12H16 ABCD12E16 -9.45 0.9 -8.83 -0.64 0
375388 131500173 1 ON3C10H11 AB3C10D11 12.11 8.46 -8.88 -1.25 0
375389 131500174 1 BrOF2N2C9H11 ABC2D2E9F11 -133.38 1.31 -8.66 -0.11 0
375390 131500175 1 ON3C10H11 AB3C10D11 37.3 5.68 -8.72 -0.94 0
375391 131500180 1 NOSC12H19 ABCD12E19 -46.43 1.61 -8.4 0.0 0
375392 131500181 1 NOC13H19 ABC13D19 -42.97 1.88 -8.99 0.3 0