List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
264325 103454079 1 ON2C10H14 AB2C10D14 2.79 5.79 -9.21 -0.04 0
264326 103454099 1 ClON2C12H17 ABC2D12E17 -20.7 2.54 -9.05 -0.39 0
264327 103454124 1 ClOC12H13 ABC12D13 -26.11 2.44 -9.48 -0.24 0
264328 103454136 1 FOC12H13 ABC12D13 -64.1 2.8 -9.7 -0.61 0
264329 103454326 1 OC14H18 AB14C18 -36.66 3.43 -9.17 -0.03 0
264330 103454489 1 O2C11H22 A2B11C22 -140.7 0.48 -9.75 2.37 0
264331 103454533 1 O3C13H18 A3B13C18 -104.29 4.23 -9.0 0.0 0
264332 103454562 3 FOC4H5 ABC4D5 -296.21 4.64 -9.74 -0.44 0
264333 103454617 1 BrO3C8H11 AB3C8D11 -110.23 0.98 -9.57 -0.23 0
264334 103454932 1 FO2C12H17 AB2C12D17 -144.08 4.51 -9.6 0.03 0
264335 103454973 1 O2F3C13H17 A2B3C13D17 -261.71 3.99 -9.98 -0.72 0
264336 103455044 2 O2C7H11 A2B7C11 -169.14 1.99 -9.1 -0.06 0
264337 103455066 2 ClOC6H8 ABC6D8 -116.11 3.11 -9.46 -0.46 0
264338 103455160 1 N2O2C13H22 A2B2C13D22 -80.85 4.36 -9.12 0.0 0
264339 103455193 1 O3C9H16 A3B9C16 -144.79 3.47 -9.61 0.01 0
264340 103455384 1 NO2C14H15 AB2C14D15 -44.08 4.49 -9.82 -1.37 0
264341 103455637 1 FO2C13H15 AB2C13D15 -107.72 5.75 -8.79 -0.07 0
264342 103455885 1 O3C13H14 A3B13C14 -81.88 5.96 -9.29 -0.73 0
264343 103456050 2 ClOC6H7 ABC6D7 -94.88 2.19 -9.68 -1.04 0
264344 103456114 1 N2O3C11H18 A2B3C11D18 -92.23 2.93 -9.04 -0.44 0
264345 103456115 1 BrN2O3C12H19 AB2C3D12E19 -100.41 2.32 -9.8 -1.06 0
264346 103456231 1 BrNO2C12H16 ABC2D12E16 -72.79 2.34 -9.87 -0.8 0
264347 103456361 1 O3C14H20 A3B14C20 -126.6 5.17 -9.15 -0.63 0
264348 103456383 1 ClO3C14H19 AB3C14D19 -146.63 5.51 -8.78 -0.14 0
264349 103456480 2 FOC6H8 ABC6D8 -188.5 1.02 -9.52 -0.26 0
264350 103456562 1 FO3C12H17 AB3C12D17 -174.44 2.91 -9.05 -0.25 0
264351 103456563 1 NO2C11H17 AB2C11D17 -89.09 1.9 -9.58 -0.05 0
264352 103456665 1 N2O2C11H20 A2B2C11D20 -94.03 3.51 -9.04 0.87 0
264353 103456666 1 N2O3C11H20 A2B3C11D20 -114.48 1.41 -8.84 0.43 0
264354 103456707 1 SO2C10H14 AB2C10D14 -63.53 2.33 -8.98 -0.22 0
264355 103456780 2 OC6H11 AB6C11 -111.92 0.7 -9.95 1.94 0
264356 103456869 1 NO2C11H15 AB2C11D15 -57.74 1.86 -9.95 -0.34 0
264357 103456913 2 OC7H10 AB7C10 -84.4 3.84 -8.97 0.24 0
264358 103456957 1 O2N3C11H19 A2B3C11D19 -52.71 3.64 -9.95 0.33 0
264359 103457055 1 NO3C14H23 AB3C14D23 -139.42 4.93 -8.95 -0.08 0
264360 103457241 1 N2O2C11H20 A2B2C11D20 -84.72 3.4 -9.49 0.69 0
264361 103457288 1 ClN2O2C14H25 AB2C2D14E25 -114.06 2.31 -9.08 0.51 0
264362 103457529 1 NO2C17H23 AB2C17D23 -86.35 2.25 -9.39 -0.11 0
264363 103457683 1 NO2C14H19 AB2C14D19 -76.05 3.31 -9.92 -0.19 0
264364 103457724 1 OC15H24 AB15C24 -76.56 3.15 -9.46 0.18 0
264365 103457728 1 ClON2C15H21 ABC2D15E21 -34.41 3.36 -8.97 -0.2 0
264366 103457731 1 ON2C17H20 AB2C17D20 -5.24 3.02 -8.78 -0.24 0
264367 103457741 1 ClON2C13H17 ABC2D13E17 -17.38 4.04 -9.36 -0.57 0
264368 103457771 1 ON2C14H20 AB2C14D20 -21.34 4.45 -8.88 -0.14 0
264369 103457853 1 NOSC14H19 ABCD14E19 -33.97 2.4 -8.88 -0.14 0
264370 103457854 1 O2C17H22 A2B17C22 -74.95 2.57 -9.24 -0.3 0
264371 103457931 1 BrOSC12H13 ABCD12E13 -10.93 4.18 -9.22 -0.92 0
264372 103458117 1 ClN2O2C14H15 AB2C2D14E15 -28.83 1.8 -9.71 -1.02 0
264373 103458119 1 O2N3H13C16 A2B3C13D16 41.11 2.93 -9.9 -1.37 0
264374 103458141 1 BrN2O2C16H19 AB2C2D16E19 -38.2 3.16 -9.39 -0.28 0
264375 103458173 1 NO3C16H17 AB3C16D17 -66.77 6.15 -9.49 -1.12 0
264376 103458196 2 OC8H11 AB8C11 -88.11 3.37 -9.63 -0.08 0
264377 103458205 1 N2O2C13H14 A2B2C13D14 -28.98 3.01 -9.28 -0.23 0
264378 103458232 2 NOH5C6 ABC5D6 -1.82 3.32 -9.75 -1.55 0
264379 103458344 1 O2C15H22 A2B15C22 -98.04 4.98 -9.53 -0.64 0
264380 103458364 2 OC6H11 AB6C11 -110.51 2.35 -9.74 0.36 0
264381 103458373 1 O3C16H24 A3B16C24 -133.9 5.94 -9.39 -0.64 0
264382 103458417 1 FO3C14H19 AB3C14D19 -168.36 4.95 -9.67 -0.78 0
264383 103458444 1 O3C16H28 A3B16C28 -174.67 2.29 -9.55 0.2 0
264384 103458476 1 O2C9H16 A2B9C16 -88.99 3.4 -9.96 -0.55 0
264385 103458593 1 NO3C16H25 AB3C16D25 -135.6 4.39 -9.44 -0.39 0
264386 103458627 1 ON2C11H16 AB2C11D16 -2.72 2.41 -9.8 0.09 0
264387 103458629 1 ON2C12H18 AB2C12D18 -11.37 6.06 -9.12 0.13 0
264388 103458633 1 OSC14H20 ABC14D20 -39.97 3.27 -9.02 0.0 0
264389 103458646 1 OC14H24 AB14C24 -77.08 3.03 -9.46 0.26 0
264390 103458695 1 ON3C14H23 AB3C14D23 -23.52 3.48 -9.69 -0.3 0
264391 103458742 1 NO2C13H17 AB2C13D17 -48.76 1.79 -9.29 -0.76 0
264392 103458793 1 BrON2C12H17 ABC2D12E17 -8.3 2.33 -9.55 -0.56 0
264393 103458908 1 OSC12H16 ABC12D16 -28.16 4.15 -9.18 -0.6 0
264394 103458965 1 OC11H18 AB11C18 -48.67 3.23 -9.6 0.18 0
264395 103459002 1 O2N3C14H25 A2B3C14D25 -88.3 3.56 -9.7 0.45 0
264396 103459055 2 ClOC7H9 ABC7D9 -112.99 1.35 -9.52 -0.5 0
264397 103459194 1 N2O2C17H30 A2B2C17D30 -108.05 3.88 -9.25 0.66 0
264398 103459248 1 O4C17H26 A4B17C26 -176.09 2.06 -8.98 0.14 0
264399 103459280 2 OC6H12 AB6C12 -143.47 0.43 -9.66 2.45 0