List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
172905 75570290 1 ClFNO2S2H15C19 ABCD2E2F15G19 -52.51 5.37 -8.73 -1.34 0
172906 75570291 1 BrClFNO2S2H14C19 ABCDE2F2G14H19 -47.44 4.13 -8.93 -1.34 0
172907 75570340 1 ISN3O3H18C25 ABC3D3E18F25 58.01 6.99 -9.04 -1.51 0
172908 75570377 1 BrN3O4H14C19 AB3C4D14E19 -32.63 7.38 -9.27 -1.62 0
172909 75570466 1 ClNO2S2F3H13C22 ABC2D2E3F13G22 -130.17 7.71 -8.85 -1.92 0
172910 75570957 1 S2N3O3H13C19 A2B3C3D13E19 57.42 7.83 -8.69 -1.7 0
172911 75571176 1 N2S2O5H16C19 A2B2C5D16E19 -30.56 4.87 -8.9 -1.63 0
172912 75572115 1 BrNS3O4H14C18 ABC3D4E14F18 -58.09 4.69 -9.08 -1.56 0
172913 75572334 1 ClN2S2O4H13C24 AB2C2D4E13F24 53.65 5.04 -9.01 -1.97 0
172914 75572335 1 ClN2S2O4H15C18 AB2C2D4E15F18 -14.64 4.69 -8.87 -1.91 0
172915 75572336 1 BrN3O6H14C22 AB3C6D14E22 -65.8 5.74 -9.64 -2.33 0
172916 75572337 1 BrS2N3O4H8C17 AB2C3D4E8F17 24.34 8.89 -9.43 -2.56 0
172917 75572563 1 NO3C16H17 AB3C16D17 -28.95 3.51 -9.5 0.18 0
172918 75572567 1 NO3C12H17 AB3C12D17 -103.44 2.83 -9.98 0.73 0
172919 75572885 1 BrSO2N4C23H27 ABC2D4E23F27 -29.27 1.69 -8.21 -0.39 0
172920 75573093 1 ClN3O4C20H22 AB3C4D20E22 -50.94 5.26 -8.74 -1.47 1
172921 75573094 1 BrO2N3C17H19 AB2C3D17E19 79.01 4.17 0.0 0.0 0
172922 75573439 1 O3N4C21H22 A3B4C21D22 -19.2 6.58 -8.66 -1.54 0
172923 75573440 1 BrSN3O5C22H24 ABC3D5E22F24 -107.74 10.32 -9.18 -1.6 0
172924 75573495 1 BrO2N4H17C18 AB2C4D17E18 55.87 3.45 -8.91 -1.47 0
172925 75573515 1 N2O5H20C23 A2B5C20D23 -15.97 5.96 -8.58 -1.23 0
172926 75573841 1 NO4H13C15 AB4C13D15 -24.86 6.88 -9.19 -1.47 0
172927 75573842 2 ClOH5C7 ABC5D7 -31.69 2.66 -9.08 -1.28 0
172928 75573843 1 NO4H13C17 AB4C13D17 -39.96 5.97 -9.2 -1.95 0
172929 75573844 2 NOH8C9 ABC8D9 -3.81 3.57 -8.6 -0.89 0