List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
249625 103090959 2 O2C6H7 A2B6C7 -143.07 3.59 -9.17 -0.5 0
249626 103090960 1 NO2H13C14 AB2C13D14 -11.11 3.91 -8.77 -0.97 0
249627 103090970 1 OC12H20 AB12C20 -68.02 3.27 -9.82 0.54 0
249628 103090974 1 OSC13H18 ABC13D18 -35.63 3.37 -9.06 -0.25 0
249629 103090979 1 ON2C14H14 AB2C14D14 35.39 2.53 -8.95 -0.6 0
249630 103090981 2 O2C7H9 A2B7C9 -125.27 2.03 -8.71 0.1 0
249631 103090984 1 NO3C14H17 AB3C14D17 -37.43 3.61 -9.74 -1.15 0
249632 103090994 1 ON2C11H16 AB2C11D16 -21.37 3.45 -9.12 0.02 0
249633 103091033 1 O2C17H18 A2B17C18 -37.68 2.5 -8.83 0.02 0
249634 103091044 1 NOC14H15 ABC14D15 -0.96 2.59 -9.28 -0.64 0
249635 103091045 1 ON3C13H15 AB3C13D15 38.8 3.03 -8.85 -0.64 0
249636 103091049 2 OC7H10 AB7C10 -81.09 0.73 -8.6 0.26 0
249637 103091051 1 O3C15H22 A3B15C22 -118.75 1.76 -8.21 0.24 0
249638 103091058 1 OC10H20 AB10C20 -77.9 2.15 -9.52 1.15 0
249639 103091074 1 BrOC12H15 ABC12D15 -36.34 2.22 -9.33 -0.07 0
249640 103091077 1 ON2C10H16 AB2C10D16 -18.71 3.69 -9.48 0.45 0
249641 103091078 1 BrOSC10H13 ABCD10E13 -33.16 1.08 -9.03 -0.47 0
249642 103091079 1 OCl2C11H12 AB2C11D12 -44.21 2.45 -9.53 -0.4 0
249643 103091082 2 BrOC6H7 ABC6D7 -57.6 2.81 -9.12 -0.54 0
249644 103091083 1 SN2O2C13H20 AB2C2D13E20 -68.69 1.65 -8.54 -0.29 0
249645 103091104 1 ON2C12H14 AB2C12D14 -0.12 2.02 -8.8 -0.24 0
249646 103091108 2 OC7H8 AB7C8 -53.96 2.85 -8.63 -0.13 0
249647 103091115 1 OSC10H14 ABC10D14 -35.5 2.55 -8.86 -0.06 0
249648 103091117 2 OC7H10 AB7C10 -80.96 2.92 -8.72 0.26 0
249649 103091142 1 BrOC12H15 ABC12D15 -36.66 1.18 -9.3 -0.02 0
249650 103091147 1 ClNOC14H14 ABCD14E14 -9.07 1.51 -9.22 -0.95 0
249651 103091151 1 O2C9H12 A2B9C12 -61.13 2.33 -8.72 -0.02 0
249652 103091155 1 NOC19H21 ABC19D21 -6.37 0.86 -8.21 -0.31 0
249653 103091158 1 NO3C12H15 AB3C12D15 -44.18 3.02 -9.5 -1.21 0
249654 103091160 1 NOC14H15 ABC14D15 0.35 3.02 -9.2 -0.68 0
249655 103091167 1 NO2C14H21 AB2C14D21 -70.19 4.5 -7.76 0.22 0
249656 103091168 1 BrOSC15H15 ABCD15E15 -1.6 2.8 -9.05 -0.69 0
249657 103091178 1 ClOC11H13 ABC11D13 -38.64 2.9 -9.32 -0.03 0
249658 103091180 1 OC14H20 AB14C20 -47.78 2.02 -9.03 0.43 0
249659 103091183 1 OC12H22 AB12C22 -76.43 1.97 -9.43 1.2 0
249660 103091186 1 BrClOC11H12 ABCD11E12 -36.7 2.53 -9.53 -0.48 0
249661 103091187 1 OC14H18 AB14C18 -16.32 2.42 -9.1 0.42 0
249662 103091190 1 BrFOC11H12 ABCD11E12 -72.6 4.21 -9.56 -0.34 0
249663 103091191 1 BrOSC9H11 ABCD9E11 -21.39 3.18 -9.18 -0.39 0
249664 103091196 1 ClO2C12H15 AB2C12D15 -75.71 3.48 -9.2 -0.23 0
249665 103091199 2 OC5H7 AB5C7 -70.37 2.73 -8.55 0.12 0
249666 103091201 1 O3C13H18 A3B13C18 -113.61 3.35 -8.91 0.32 0
249667 103091205 1 O2C13H18 A2B13C18 -76.62 1.01 -8.44 0.38 0
249668 103091210 1 ON2C11H18 AB2C11D18 -28.36 1.7 -8.77 0.75 0
249669 103091224 1 O3C13H18 A3B13C18 -109.49 4.97 -8.5 0.28 0
249670 103091230 1 OC12H22 AB12C22 -80.33 2.27 -9.48 1.15 0
249671 103091234 1 NOC13H21 ABC13D21 -53.64 2.69 -8.18 1.3 0
249672 103091237 1 O3C15H20 A3B15C20 -114.67 3.04 -8.49 0.13 0
249673 103091253 1 Br2O2C13H16 A2B2C13D16 -67.39 3.1 -9.38 -0.55 0
249674 103091280 1 FNO3C11H12 ABC3D11E12 -77.94 8.02 -9.88 -1.47 0
249675 103091300 1 FOC12H15 ABC12D15 -85.13 1.77 -9.37 0.05 0
249676 103091304 1 ClFOC11H12 ABCD11E12 -85.27 4.13 -9.45 -0.31 0
249677 103091312 2 O2C7H10 A2B7C10 -136.83 3.29 -8.6 0.15 0
249678 103091316 1 ON2C10H14 AB2C10D14 -18.46 1.47 -9.77 -0.45 0
249679 103091321 1 N2O2C11H18 A2B2C11D18 -55.44 4.54 -9.06 0.57 0
249680 103091323 1 ON2C9H14 AB2C9D14 -11.32 4.07 -9.42 0.42 0
249681 103091324 1 ClNSF2O5C11H12 ABCD2E5F11G12 -286.94 3.1 -10.42 -1.77 0
249682 103091352 1 NS2O5C12H17 AB2C5D12E17 -190.84 4.29 -9.9 -1.38 0
249683 103091353 1 BrNS2O5C11H14 ABC2D5E11F14 -174.7 7.96 -9.65 -1.78 0
249684 103091356 1 FNSO5C13H16 ABCD5E13F16 -235.13 4.97 -9.96 -1.41 0
249685 103091358 1 SN2O5C11H16 AB2C5D11E16 -191.76 4.4 -9.92 -0.87 0
249686 103091361 1 NSO5C13H17 ABC5D13E17 -188.46 1.86 -10.0 -1.28 0
249687 103091367 1 NS2O5C12H17 AB2C5D12E17 -191.7 5.47 -9.73 -1.72 0
249688 103091371 1 NS2O5C11H15 AB2C5D11E15 -180.36 4.76 -9.96 -1.58 0
249689 103091372 1 SN2O5C13H20 AB2C5D13E20 -201.03 6.48 -9.93 -0.72 0
249690 103091386 1 ClN2O3C13H17 AB2C3D13E17 -97.86 5.99 -9.23 -0.81 0
249691 103091392 1 N2O2C13H16 A2B2C13D16 -10.99 1.95 -8.96 -0.46 0
249692 103091395 1 NO2C13H19 AB2C13D19 -53.35 3.37 -8.25 0.04 0
249693 103091401 1 N3C10H17 A3B10C17 27.29 1.4 -8.44 0.58 0
249694 103091406 2 NC7H10 AB7C10 19.94 4.02 -7.92 0.21 0
249695 103091411 1 ClNOC10H12 ABCD10E12 -26.08 0.74 -8.96 -0.44 0
249696 103091415 2 NOC5H6 ABC5D6 23.74 5.5 -9.61 -1.38 0
249697 103091418 1 N3C10H17 A3B10C17 25.71 4.82 -8.71 0.08 0
249698 103091425 1 ON2C12H14 AB2C12D14 20.07 4.81 -9.05 -0.73 0
249699 103091429 1 BrNO2C11H12 ABC2D11E12 -32.06 1.04 -8.9 -0.65 0