List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
89048 49958965 1 BrN2O3C19H19 AB2C3D19E19 -28.68 5.01 -8.99 -0.61 0
89049 49958967 1 ON2H16C17 AB2C16D17 47.95 4.31 -9.62 -0.22 0
89050 49958968 1 ON2H16C18 AB2C16D18 74.78 3.96 -9.52 -0.33 0
89051 49958969 1 ON2C21H22 AB2C21D22 35.94 4.05 -9.59 -0.14 0
89052 49958995 1 Br2N2O3H16C21 A2B2C3D16E21 8.6 3.56 -8.92 -1.1 0
89053 49959005 2 NOH9C11 ABC9D11 49.56 5.09 -8.72 -1.13 0
89054 49959016 1 Cl2N2O3H18C22 A2B2C3D18E22 -22.92 3.38 -8.96 -0.75 0
89055 49959020 1 BrN2O3H19C22 AB2C3D19E22 -4.55 3.44 -9.01 -0.88 0
89056 49959021 1 N2O3H16C20 A2B3C16D20 7.13 6.36 -8.73 -0.95 0
89057 49959022 1 IN2O3H15C17 AB2C3D15E17 -7.24 2.5 -8.9 -1.02 0
89058 49959023 1 BrN2O3H17C21 AB2C3D17E21 10.24 5.36 -8.76 -0.98 0
89059 49959067 1 N2O3H6C7 A2B3C6D7 -20.2 2.37 -9.3 -0.94 0
89060 49959073 1 N2O3C13H16 A2B3C13D16 -46.49 3.02 -8.82 -0.55 0
89061 49959074 1 IN2O3H9C10 AB2C3D9E10 -17.74 1.1 -8.98 -1.01 0
89062 49959076 1 N2O3C11H12 A2B3C11D12 -38.55 2.79 -8.98 -0.55 0
89063 49959077 1 N2O3C12H14 A2B3C12D14 -46.26 3.04 -8.7 -0.55 0
89064 49959104 1 N2O4C13H14 A2B4C13D14 -58.22 3.47 -8.48 -0.8 0
89065 49959105 1 N2O2C11H12 A2B2C11D12 -6.99 2.49 -9.56 -0.24 0
89066 49959112 2 NOC6H6 ABC6D6 8.08 3.5 -8.97 -0.9 0
89067 49959119 1 Br2N2O3H8C10 A2B2C3D8E10 -20.14 4.36 -9.29 -0.81 0
89068 49959120 1 N2O4C11H12 A2B4C11D12 -64.22 3.02 -8.74 -0.42 0
89069 49959133 1 N2O3H14C16 A2B3C14D16 0.11 3.9 -9.07 -1.38 0
89070 49959135 1 BrN2O3C19H19 AB2C3D19E19 -21.5 5.86 -9.07 -0.92 0
89071 49959137 1 BrN3O4H12C19 AB3C4D12E19 49.61 2.61 -8.9 -1.83 0
89072 49959138 1 BrN4O6H11C19 AB4C6D11E19 50.91 7.02 -9.06 -2.38 0
89073 49959153 1 BrN2O2C19H19 AB2C2D19E19 1.78 4.25 -8.94 -0.95 0
89074 49959174 1 BrFN2O2H12C19 ABC2D2E12F19 5.05 4.0 -8.95 -1.16 0
89075 49959198 1 BrN2O3H17C18 AB2C3D17E18 -16.54 4.35 -8.88 -0.92 0
89076 49959199 1 Br2N2O3H14C17 A2B2C3D14E17 -7.44 4.48 -9.01 -1.03 0
89077 49959208 1 N2O3C21H24 A2B3C21D24 -44.83 2.39 -8.78 -0.67 0
89078 49959209 1 BrN2O3H17C21 AB2C3D17E21 9.4 4.92 -8.81 -0.99 0
89079 49959211 1 BrN2O3H17C18 AB2C3D17E18 -19.82 3.89 -8.94 -0.98 0
89080 49959213 1 BrClN2O3H14C17 ABC2D3E14F17 -17.07 2.98 -9.18 -1.0 0
89081 49959215 1 N2O2C13H16 A2B2C13D16 -24.79 4.15 -9.04 -0.54 0
89082 49959223 1 N2O3C19H20 A2B3C19D20 -25.24 3.65 -8.87 -0.88 0
89083 49959224 1 N2O3H20C23 A2B3C20D23 9.93 4.28 -9.04 -0.98 0
89084 49959243 1 Br2N2O3H14C17 A2B2C3D14E17 -8.83 3.19 -9.16 -1.07 0
89085 49959245 1 N2O2H18C19 A2B2C18D19 23.08 4.12 -8.77 -1.07 0
89086 49959255 1 N2O2C13H16 A2B2C13D16 -21.87 3.8 -8.92 -0.54 0
89087 49959265 1 BrN2O3C19H19 AB2C3D19E19 -25.54 1.7 -9.08 -0.89 0
89088 49959271 1 BrN2O3H17C18 AB2C3D17E18 -16.55 3.09 -9.06 -1.06 0
89089 49959305 2 ClNOH9C10 ABCD9E10 -1.2 4.92 -9.11 -1.0 0
89090 49959310 1 ClN2O4H17C19 AB2C4D17E19 -43.8 5.87 -8.34 -1.2 0
89091 49959338 1 Br2N2O5H18C19 A2B2C5D18E19 -102.4 6.03 -8.69 -1.22 0
89092 49959339 1 BrN2O5C20H21 AB2C5D20E21 -94.62 3.12 -8.95 -1.14 0
89093 49959340 2 NO2C10H10 AB2C10D10 -46.93 6.7 -8.76 -1.15 0
89094 49959349 1 Br2N2O3H14C17 A2B2C3D14E17 -10.98 1.52 -9.02 -1.04 0
89095 49959363 1 Cl2N2O2H16C21 A2B2C2D16E21 16.0 4.08 -9.02 -0.74 0
89096 49959366 1 BrCl2N2O3H11C15 AB2C2D3E11F15 -23.03 4.77 -8.97 -1.35 0
89097 49959367 1 BrCl2N2O3H17C19 AB2C2D3E17F19 -47.74 2.98 -8.98 -0.76 0
89098 49959368 1 Cl2N2O3C20H20 A2B2C3D20E20 -54.86 5.41 -8.76 -0.64 0
89099 49959372 1 FCl2N2O2H13C17 AB2C2D2E13F17 -52.12 2.15 -9.15 -1.12 0
89100 49959384 1 N2Cl3O3H15C18 A2B3C3D15E18 -43.16 5.26 -9.06 -0.86 0
89101 49959385 2 ClNOH9C11 ABCD9E11 4.84 5.64 -8.93 -0.75 0
89102 49959391 1 Cl2N3O5H15C18 A2B3C5D15E18 -43.29 7.36 -9.16 -1.39 0
89103 49959392 1 ICl2N2O2H15C18 AB2C2D2E15F18 1.83 2.5 -9.05 -1.15 0
89104 49959394 1 SCl2N2O2H12C16 AB2C2D2E12F16 22.2 4.81 -9.13 -1.47 0
89105 49959399 1 Cl2N2O3H14C17 A2B2C3D14E17 -24.34 3.15 -8.98 -1.27 0
89106 49959411 1 BrClN2O3H16C18 ABC2D3E16F18 -29.2 2.88 -9.13 -1.17 0
89107 49959423 1 Br2N3O4H11C16 A2B3C4D11E16 23.68 2.86 -9.81 -2.2 0
89108 49959428 1 BrN3O4H12C16 AB3C4D12E16 22.07 3.31 -9.33 -2.19 0
89109 49959434 1 N3O3H13C19 A3B3C13D19 71.13 5.54 -9.23 -2.01 0
89110 49959472 1 BrCl2N2O3H15C18 AB2C2D3E15F18 -34.69 5.14 -9.08 -0.84 0
89111 49959477 1 ClN2O3H19C23 AB2C3D19E23 -0.05 5.86 -8.96 -1.04 0
89112 49959478 1 BrClN2O3H14C17 ABC2D3E14F17 -24.53 4.78 -8.97 -1.23 0
89113 49959479 1 BrClN2O3H10C14 ABC2D3E10F14 -4.97 3.33 -9.05 -1.48 0
89114 49959484 1 ClFN2O2H12C16 ABC2D2E12F16 -35.44 3.25 -9.06 -1.38 0
89115 49959498 1 N3O4H13C17 A3B4C13D17 31.91 8.83 -9.15 -1.94 0
89116 49959499 1 N3O4H15C21 A3B4C15D21 50.96 5.31 -9.09 -2.15 0
89117 49959500 1 ClN4O6H11C16 AB4C6D11E16 11.4 3.33 -9.34 -2.5 0
89118 49959501 1 ClN2O2C12H13 AB2C2D12E13 -26.65 4.3 -8.99 -0.72 0
89119 49959506 1 ClN2O3H11C14 AB2C3D11E14 -13.38 4.39 -9.01 -1.35 0
89120 49959511 1 Cl2N2O3H16C18 A2B2C3D16E18 -37.84 2.86 -9.11 -1.14 0
89121 49959513 1 ClN2O3H13C16 AB2C3D13E16 -6.83 4.48 -9.08 -1.47 0
89122 49959514 1 BrClN2O2H14C17 ABC2D2E14F17 5.28 4.33 -9.1 -1.3 0
89123 49959515 1 BrClN2O3H18C19 ABC2D3E18F19 -33.11 3.32 -9.0 -0.79 0
89124 49959524 1 N4O6H10C15 A4B6C10D15 21.66 4.86 -10.26 -2.08 0
89125 49959527 1 Br2N3O5H13C17 A2B3C5D13E17 -8.29 9.37 -9.82 -1.36 0
89126 49959530 1 N3O5C20H21 A3B5C20D21 -37.53 5.45 -8.99 -1.42 0
89127 49959531 1 BrN3O5H14C17 AB3C5D14E17 -20.52 6.99 -9.27 -1.44 0
89128 49959532 1 N3O5H17C18 A3B5C17D18 -27.32 7.7 -8.94 -1.38 0
89129 49959543 1 BrClN3O5H11C16 ABC3D5E11F16 -13.63 4.92 -9.54 -1.45 0
89130 49959549 1 ClN2Br3O3H10C16 AB2C3D3E10F16 -1.89 1.38 -9.33 -1.15 0
89131 49959551 1 N2Br3O3H15C18 A2B3C3D15E18 -2.78 6.94 -9.07 -1.15 0
89132 49959552 2 BrNOH7C9 ABCD7E9 39.78 5.18 -9.28 -1.2 0
89133 49959555 1 Br2N2O2C15H16 A2B2C2D15E16 -13.53 4.18 -9.39 -0.74 0
89134 49959558 1 SBr2N2O2H10C15 AB2C2D2E10F15 55.67 3.46 -9.39 -1.42 0
89135 49959561 1 N2O2Br3H11C16 A2B2C3D11E16 30.65 1.8 -9.43 -1.21 0
89136 49959562 1 N2Br3O3H15C18 A2B3C3D15E18 -7.97 1.66 -9.34 -1.0 0
89137 49959567 1 N2Br3O3H13C17 A2B3C3D13E17 -3.45 1.21 -9.22 -1.16 0
89138 49959573 1 Br2N2O3H16C18 A2B2C3D16E18 -13.03 4.23 -8.95 -0.99 0
89139 49959596 1 Br2N2O3H16C18 A2B2C3D16E18 -30.46 4.38 -9.16 -1.04 0
89140 49959597 1 BrN2O2H15C18 AB2C2D15E18 36.01 6.34 -9.21 -1.14 0
89141 49959635 1 N2O3H8C11 A2B3C8D11 -5.9 4.81 -9.18 -1.11 0
89142 49959643 1 N2O2C13H16 A2B2C13D16 -32.36 2.88 -9.26 -0.49 0
89143 49959644 1 BrN2O3H11C14 AB2C3D11E14 -10.89 4.5 -9.26 -1.0 0
89144 49959668 1 ClBr2N2O3H13C17 AB2C2D3E13F17 -10.39 6.0 -9.04 -1.09 0
89145 49959669 1 BrClN2O2H14C18 ABC2D2E14F18 28.92 5.36 -8.98 -1.23 0
89146 49959670 1 BrClN2O3H14C17 ABC2D3E14F17 -17.39 6.08 -9.13 -1.03 0
89147 49959671 1 BrN2O2H17C21 AB2C2D17E21 34.74 6.29 -8.93 -0.73 0