List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
55001 17389644 1 ClNC8H18 ABC8D18 -60.02 0.87 -8.62 2.05 0
55002 17389645 2 NO2C8H12 AB2C8D12 -161.94 11.54 -9.41 -0.68 0
55003 17389646 1 NO4C11H21 AB4C11D21 -191.66 1.64 -8.64 -1.45 0
55004 17389647 1 N2O4C11H22 A2B4C11D22 -194.05 10.92 -9.18 0.39 0
55005 17389649 1 ClFNO2C11H13 ABCD2E11F13 -147.71 3.87 -9.94 -0.5 0
55006 17389650 1 FNO2C11H12 ABC2D11E12 -111.96 1.81 -9.76 -0.4 0
55007 17389651 1 NCl2O2C11H13 AB2C2D11E13 -111.12 5.12 -9.48 -0.28 0
55008 17389652 1 ClNO2C11H12 ABC2D11E12 -73.85 2.66 -9.67 -0.47 0
55009 17389653 1 ClKSO2H4C9 ABCD2E4F9 -95.56 9.83 -8.23 -0.33 0
55010 17389655 1 ClNC13H20 ABC13D20 -31.54 1.24 -9.04 0.42 0
55011 17389656 1 NO5C14H19 AB5C14D19 -192.26 4.17 -9.07 -1.06 0
55012 17389658 1 NO4C11H21 AB4C11D21 -190.73 1.57 -8.74 -1.44 0
55013 17389660 1 BrNH6C8 ABC6D8 67.84 1.18 -9.55 -0.66 0
55014 17389661 1 ClNC15H24 ABC15D24 -46.12 3.85 -9.34 0.28 0
55015 17389662 1 NO4C12H23 AB4C12D23 -199.82 2.02 -8.72 -1.11 0
55016 17389665 1 ClNSO2C10H10 ABCD2E10F10 -85.75 6.24 -8.51 -1.36 0
55017 17389666 1 N2O5C10H18 A2B5C10D18 -209.09 1.54 -8.87 -1.49 0
55018 17389667 1 NF5C10H16 AB5C10D16 -284.19 4.8 -9.49 0.8 0
55019 17389668 1 NF5C10H16 AB5C10D16 -284.31 5.2 -9.51 1.11 0
55020 17389669 1 NF6H11C12 AB6C11D12 -286.85 4.63 -9.99 -0.44 0
55021 17389670 1 NF8H11C13 AB8C11D13 -401.28 4.74 -10.11 -0.9 0
55022 17389671 1 NOF5C13H14 ABC5D13E14 -280.3 5.68 -9.13 -0.04 0
55023 17389672 1 NF5C12H12 AB5C12D12 -238.98 4.74 -9.82 -0.17 0
55024 17389673 1 NF5C13H14 AB5C13D14 -238.37 4.38 -9.46 -0.18 0
55025 17389674 1 NC11H17 AB11C17 23.77 3.42 -10.45 2.39 0
55026 17389675 2 NC4H4 AB4C4 74.63 0.53 -10.35 -0.37 0
55027 17389676 1 ClNSC10H16 ABCD10E16 -27.51 1.03 -8.98 -0.24 0
55028 17389677 1 NOC12H17 ABC12D17 -31.33 2.01 -8.52 0.31 0
55029 17389678 1 NO5C15H21 AB5C15D21 -197.85 4.24 -8.74 -1.14 0
55030 17389679 1 NOC13H19 ABC13D19 -34.83 2.61 -8.47 0.33 0
55031 17389680 1 NO4C13H25 AB4C13D25 -209.01 3.33 -8.86 -0.32 0
55032 17389681 1 NO4C12H21 AB4C12D21 -192.07 3.27 -8.95 0.0 0
55033 17389682 1 NO5C16H23 AB5C16D23 -202.36 3.23 -8.92 -1.07 0
55034 17389683 1 NO4C11H21 AB4C11D21 -193.93 2.06 -9.09 -1.29 0
55035 17389686 1 NO3C14H17 AB3C14D17 -124.48 4.06 -9.59 -0.11 0
55036 17389687 1 NO5C15H19 AB5C15D19 -197.42 7.49 -9.04 -0.16 0
55037 17389688 1 KNSO2H6C9 ABCD2E6F9 -87.0 7.11 -7.61 -0.01 0
55038 17389689 1 ClNC14H24 ABC14D24 -72.5 3.22 -9.21 2.0 0
55039 17389690 2 NOH3C4 ABC3D4 60.88 3.39 -10.32 -1.7 0
55040 17389692 1 NOCl2C13H19 ABC2D13E19 -83.52 5.16 -9.09 -0.26 0
55041 17389693 1 ClNOC13H18 ABCD13E18 -41.83 3.2 -8.83 0.02 0
55042 17389694 1 NO4C17H19 AB4C17D19 -136.99 7.37 -8.97 -0.62 0
55043 17389695 1 NO4C10H17 AB4C10D17 -166.56 1.72 -9.04 -1.47 0
55044 17389696 1 NOCl2C11H15 ABC2D11E15 -67.04 3.41 -9.12 -0.44 0
55045 17389697 1 ClNOC11H14 ABCD11E14 -30.31 2.26 -8.73 -0.16 0
55046 17389698 1 NO4C18H21 AB4C18D21 -139.53 3.8 -8.94 -1.01 0
55047 17389699 1 NF2C12H13 AB2C12D13 -80.96 4.55 -8.73 -0.33 0
55048 17389700 2 NO2C5H10 AB2C5D10 -188.54 9.93 -9.56 0.24 0
55049 17389701 1 NO4C11H19 AB4C11D19 -193.54 11.19 -9.66 0.58 0
55050 17389702 1 NCl3C12H16 AB3C12D16 -49.57 5.94 -9.62 -0.52 0
55051 17389703 1 NCl2O2C14H21 AB2C2D14E21 -112.87 4.96 -8.69 -0.22 0
55052 17389704 1 ClNO2C14H20 ABC2D14E20 -75.12 4.43 -8.36 0.03 0
55053 17389706 1 NOCl2C12H17 ABC2D12E17 -75.64 2.03 -9.04 -0.38 0
55054 17389707 1 ClNOC12H16 ABCD12E16 -37.41 0.72 -8.75 -0.14 0
55055 17389708 1 ClNO5C12H12 ABC5D12E12 -182.58 7.98 -9.83 -1.39 0
55056 17389709 1 FNC18H20 ABC18D20 -40.51 4.73 -8.59 -0.14 0
55057 17389710 1 NC19H23 AB19C23 0.43 2.14 -8.24 0.27 0
55058 17389711 1 NSH13C14 ABC13D14 47.77 2.33 -8.15 -0.36 0
55059 17389713 1 NO4C15H19 AB4C15D19 -159.87 5.0 -9.62 -0.12 0
55060 17389714 1 NO5C16H23 AB5C16D23 -195.69 2.5 -8.58 -1.43 0
55061 17389715 1 BrClNO2C14H21 ABCD2E14F21 -98.08 4.06 -8.59 -0.29 0
55062 17389716 1 BrNO2C14H20 ABC2D14E20 -63.0 4.27 -8.43 -0.03 0
55063 17389719 1 BrNOC12H16 ABCD12E16 -27.66 2.6 -8.8 -0.17 0
55064 17389720 1 ClN4C9H11 AB4C9D11 33.7 3.09 -9.0 -0.61 0
55065 17389721 1 ClNSO2C7H10 ABCD2E7F10 -93.51 6.41 -9.52 -1.26 0
55066 17389722 2 ClON2C5H8 ABC2D5E8 -48.36 0.95 -9.48 -1.52 0
55067 17389724 1 NO2H21C23 AB2C21D23 5.74 1.76 -9.37 -0.08 0
55068 17389725 1 ClN3O3C10H12 AB3C3D10E12 -67.48 5.79 -9.6 -0.83 0
55069 17389726 1 ClSO2N3C11H14 ABC2D3E11F14 -47.66 7.83 -9.23 -1.1 0
55070 17389727 1 NSBr2C9H13 ABC2D9E13 7.01 2.71 -9.23 -0.42 0
55071 17389728 1 NSBr2C10H15 ABC2D10E15 -3.76 3.65 -9.24 -0.42 0
55072 17389729 2 NO4C8H11 AB4C8D11 -319.66 3.95 -8.43 -1.57 0
55073 17389730 2 NO4C8H11 AB4C8D11 -342.94 11.74 -8.83 -0.8 0
55074 17389731 2 NC6H9 AB6C9 6.82 2.2 -8.27 0.6 0
55075 17389732 2 NO4C8H11 AB4C8D11 -321.13 6.86 -8.94 -1.17 0
55076 17389733 2 NC6H9 AB6C9 9.47 2.62 -7.85 0.67 0
55077 17389735 1 N2C13H20 A2B13C20 4.32 2.41 -8.16 0.47 0
55078 17389737 1 ON2C12H18 AB2C12D18 -20.14 1.76 -7.88 0.46 0
55079 17389740 1 BrN2O8C15H19 AB2C8D15E19 -306.45 8.73 -8.22 -1.74 0
55080 17389741 1 BrN2C11H15 AB2C11D15 19.07 5.42 -8.25 0.23 0
55081 17389742 1 FN2O8C15H19 AB2C8D15E19 -357.61 3.02 -8.88 -1.49 0
55082 17389743 1 FN2C11H15 AB2C11D15 -30.55 5.28 -8.22 0.2 0
55083 17389744 1 Cl2N2O4C13H16 A2B2C4D13E16 -174.99 10.96 -8.91 -0.38 0
55084 17389745 1 Cl2N2C11H14 A2B2C11D14 -3.21 3.99 -8.55 -0.2 0
55085 17389746 1 ClN2O8C16H21 AB2C8D16E21 -331.09 4.9 -8.65 -1.31 0
55086 17389747 1 ClN2C12H17 AB2C12D17 -0.94 5.06 -8.22 0.33 0
55087 17389748 2 ClNC6H9 ABC6D9 -37.41 4.74 -8.47 -0.11 0
55088 17389751 1 N2C13H20 A2B13C20 -3.99 2.43 -8.23 0.75 0
55089 17389752 1 N2O9C16H22 A2B9C16D22 -347.77 4.66 -8.45 -1.36 0
55090 17389753 1 ON2C12H18 AB2C12D18 -21.71 2.56 -7.85 0.32 0
55091 17389754 1 ClN2F3O8C16H18 AB2C3D8E16F18 -480.34 7.06 -8.74 -1.23 0
55092 17389755 1 ClN2F3C12H14 AB2C3D12E14 -155.05 5.15 -8.61 -0.55 0
55093 17389756 2 NO4C8H11 AB4C8D11 -298.39 3.77 -8.98 -1.51 0
55094 17389757 1 NOCl2C12H17 ABC2D12E17 -71.09 3.97 -8.77 -0.09 0
55095 17389758 1 ClNOC12H16 ABCD12E16 -39.2 2.56 -8.75 -0.17 0
55096 17389759 1 ClNOC12H18 ABCD12E18 -62.44 1.78 -9.07 -0.11 0
55097 17389760 1 NO4C10H19 AB4C10D19 -187.43 2.24 -9.14 -1.36 0
55098 17389762 1 FN2O2C11H11 AB2C2D11E11 -112.7 2.43 -9.17 -0.44 0
55099 17389763 1 N2O2C13H16 A2B2C13D16 -79.08 1.41 -8.82 -0.09 0
55100 17389764 1 BrN2O2C11H11 AB2C2D11E11 -63.52 2.93 -9.17 -0.58 0