List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
336938 127255945 1 ClNO2C20H26 ABC2D20E26 -103.3 4.32 -9.06 -0.12 0
336939 127255946 1 ClNO2C20H26 ABC2D20E26 -104.96 3.63 -9.05 -0.07 0
336940 127255947 1 ClNO2C19H24 ABC2D19E24 -98.22 1.63 -9.19 -0.17 0
336941 127255948 1 NO2C19H23 AB2C19D23 -60.72 1.86 -8.87 0.08 0
336942 127255949 1 ClNO2C21H28 ABC2D21E28 -110.88 3.02 -8.75 0.18 0
336943 127255950 1 NO2C21H27 AB2C21D27 -76.01 2.95 -8.82 0.1 0
336944 127255951 1 NO4C22H23 AB4C22D23 -154.48 8.27 -9.31 -0.5 0
336945 127255952 1 NO5C24H27 AB5C24D27 -177.29 6.13 -8.83 -0.5 0
336946 127255953 1 NO5C24H27 AB5C24D27 -180.85 6.74 -9.4 -1.06 0
336947 127255954 2 ClNOC3H7 ABCD3E7 -162.3 1.67 -9.62 0.26 0
336948 127255955 1 ClNBr2O2H4C7 ABC2D2E4F7 -51.38 3.43 -10.16 -1.77 0
336949 127255956 1 ClON2F3C7H8 ABC2D3E7F8 -206.45 3.24 -10.11 -1.03 0
336950 127255957 1 SP3N5O12C17H22 AB3C5D12E17F22 -631.44 3.17 -8.79 -0.8 0
336951 127256106 1 BrH17C30 AB17C30 124.56 2.0 -8.4 -1.28 0
336952 127256107 1 INC32H32 ABC32D32 82.67 2.61 -7.74 -0.7 0
336953 127256108 1 BrNH20C31 ABC20D31 140.26 1.54 -8.3 -0.66 0
336954 127256109 1 N2O2H40C57 A2B2C40D57 163.01 1.39 -7.76 -0.59 0
336955 127256110 1 N2O3H12C13 A2B3C12D13 14.13 8.5 -9.79 -1.35 0
336956 127256111 1 N2O3H10C12 A2B3C10D12 20.87 6.22 -9.6 -1.45 0
336957 127256112 1 BrN2O3H9C12 AB2C3D9E12 23.54 4.67 -9.61 -1.55 0
336958 127256113 1 Br2N2O2H4C9 A2B2C2D4E9 -14.31 4.17 -10.36 -2.1 0
336959 127256114 1 Br2N2O2H8C11 A2B2C2D8E11 -23.47 5.71 -10.07 -1.88 0
336960 127256115 1 BrN2O2H5C9 AB2C2D5E9 -18.77 5.49 -10.48 -1.89 0
336961 127256116 1 BrN2O2H9C11 AB2C2D9E11 -27.63 6.66 -10.11 -1.67 0
336962 127256117 1 Br2N2O2H4C9 A2B2C2D4E9 -3.09 6.45 -10.39 -2.19 0
336963 127256118 1 BrN2O2H9C11 AB2C2D9E11 -15.19 4.71 -10.06 -1.53 0
336964 127256529 1 SO10N16C40H62 AB10C16D40E62 -302.45 5.51 -7.42 -0.34 0
336965 127256530 2 NOH6C9 ABC6D9 44.6 9.67 -7.65 -1.58 0
336966 127256531 1 NaPSN2O8C9H12 ABCD2E8F9G12 -406.12 22.32 -8.88 -1.62 0
336967 127256532 1 ClNSO5C6H8 ABCD5E6F8 -203.82 1.58 -8.55 -1.08 0
336968 127256533 1 SN3O6C13H17 AB3C6D13E17 -225.6 3.93 -9.48 -1.76 0
336969 127256534 1 OCl4H10C18 AB4C10D18 -0.02 2.58 -9.22 -0.88 0
336970 127256535 1 PNa2N5O7C10H12 AB2C5D7E10F12 -421.81 20.85 -9.24 -0.43 0
336971 127256536 1 PN2Na2O9C13H13 AB2C2D9E13F13 -522.74 5.43 -8.61 -0.06 0
336972 127256537 1 PN2Na2O11C13H15 AB2C2D11E13F15 -624.73 21.23 -8.66 -1.57 0
336973 127256538 1 PN2O11C13H17 AB2C11D13E17 -524.4 4.5 -10.61 -1.36 0
336974 127256539 1 PN2Na2O10C13H15 AB2C2D10E13F15 -557.36 22.49 -8.45 -1.82 0
336975 127256540 1 PN2O10C13H17 AB2C10D13E17 -462.25 5.24 -9.35 -0.74 0
336976 127256541 1 PN2Na2O10C12H15 AB2C2D10E12F15 -591.88 14.38 -8.55 -0.68 0
336977 127256542 1 PN2O10C12H17 AB2C10D12E17 -485.53 5.72 -9.78 -0.68 0
336978 127256543 1 IPN2Na2O10C11H12 ABC2D2E10F11G12 -596.01 4.46 -8.75 -0.58 0
336979 127256544 1 IPN2O10C11H14 ABC2D10E11F14 -460.52 5.17 -9.71 -1.6 0
336980 127256545 1 BrPN2Na2O10C11H12 ABC2D2E10F11G12 -596.48 14.1 -8.85 -0.64 0
336981 127256546 1 BrPN2O10C11H14 ABC2D10E11F14 -472.13 6.78 -9.78 -0.91 0
336982 127256547 1 PN2Na2O9C13H17 AB2C2D9E13F17 -425.07 51.01 -7.31 -3.03 0
336983 127256548 1 PN2Na2O9C13H15 AB2C2D9E13F15 -559.05 12.51 -9.27 -1.05 0
336984 127256549 1 ON2C19H24 AB2C19D24 21.15 1.57 -8.61 0.24 0
336985 127256550 1 SN4O4C19H20 AB4C4D19E20 -109.82 8.83 -8.67 -1.34 0
336986 127256551 1 N3O8H21C22 A3B8C21D22 -116.44 9.19 -9.26 -1.98 0
336987 127256552 2 ClH13C15 AB13C15 86.76 3.45 -9.38 0.0 0