List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
13023 220027 1 NSC10H11 ABC10D11 44.8 3.29 -9.02 -0.18 0
13024 220028 1 SO4C14H18 AB4C14D18 -163.03 4.37 -9.06 -0.5 0
13025 220032 1 NSC10H11 ABC10D11 39.25 4.27 -8.93 -0.35 0
13026 220039 2 OC6H10 AB6C10 -117.39 5.34 -9.38 0.76 0
13027 220044 1 O2C13H20 A2B13C20 -92.91 1.51 -8.84 0.25 0
13028 220045 2 OC9H18 AB9C18 -171.81 4.47 -10.18 3.0 0
13029 220046 1 O3C11H14 A3B11C14 -127.0 5.28 -9.26 -0.06 0
13030 220066 1 OC16H34 AB16C34 -129.4 1.76 -10.18 2.9 0
13031 220082 2 ClNOH3C7 ABCD3E7 -2.66 1.45 -9.26 -1.25 0
13033 220131 3 O3C6H10 A3B6C10 -422.71 4.59 -10.16 0.16 0
13034 220174 1 SN2C10H10 AB2C10D10 50.87 1.59 -8.75 -0.35 0
13035 220200 1 O7C19H20 A7B19C20 -261.27 1.97 -10.05 -0.94 0
13036 220216 1 Cl6O7H12C18 A6B7C12D18 -270.09 2.95 -9.46 -1.4 0
13037 220224 1 PO3C4H11 AB3C4D11 -184.21 1.29 -10.96 0.89 0
13038 220225 3 NPCl2 ABC2 -167.32 0.02 -10.86 -1.18 0
13039 220247 1 SO4C6H12 AB4C6D12 -193.76 6.42 -10.48 0.27 0
13040 220271 1 NO2C8H17 AB2C8D17 -123.68 2.65 -9.77 1.04 0
13041 220295 1 O3H10C13 A3B10C13 -71.62 3.29 -9.31 -0.61 0
13042 220296 2 ClC5H6 AB5C6 -24.6 1.4 -9.25 -0.2 0
13043 220312 1 ClO3C10H11 AB3C10D11 -121.7 3.39 -9.37 -0.42 0
13044 220313 1 OI2H6C7 AB2C6D7 2.01 1.32 -9.12 -1.32 0
13045 220314 1 ClO2C10H11 AB2C10D11 -46.34 2.03 -8.44 -0.05 0
13046 220331 1 O2N3C10H11 A2B3C10D11 -30.37 4.39 -9.09 -1.06 0
13047 220347 1 O3C21H28 A3B21C28 -144.33 2.76 -9.34 -0.37 0
13048 220360 1 NO3C21H23 AB3C21D23 -91.17 7.34 -10.3 -1.21 0
13049 220368 1 ClN2O2H11C13 AB2C2D11E13 31.59 5.02 -10.32 -1.36 0
13050 220377 1 SO3C8H8 AB3C8D8 -85.41 5.08 -10.31 -0.87 0
13051 220379 1 Br2H8C9 A2B8C9 45.48 1.83 -9.61 -0.75 0
13052 220384 1 NO5C18H25 AB5C18D25 -149.63 8.55 -10.26 -1.22 0
13053 220389 1 N4O5H18C19 A4B5C18D19 6.11 3.92 -10.74 -1.6 0
13054 220391 1 N3O6H19C20 A3B6C19D20 -35.77 5.01 -10.66 -1.54 0
13055 220399 1 OH10C13 AB10C13 9.58 4.42 -8.85 -0.89 0
13056 220400 5 NC3H3 AB3C3 97.72 3.81 -9.12 -0.17 0
13057 220404 1 ON3C8H17 AB3C8D17 -50.12 4.41 -9.21 0.5 0
13058 220407 1 NO2H13C14 AB2C13D14 -29.81 4.74 -8.49 -0.38 0
13059 220439 1 NO2H11C12 AB2C11D12 -44.38 1.9 -9.02 -0.81 0
13060 220451 2 PO3C7H16 AB3C7D16 -426.99 4.01 -10.49 1.12 0
13061 220477 1 N3O3C14H15 A3B3C14D15 -89.84 5.49 -9.78 -0.48 0
13062 220479 1 N3O4C9H13 A3B4C9D13 -168.92 3.88 -9.8 -1.06 0
13063 220493 1 NOH13C17 ABC13D17 35.36 2.58 -9.37 -0.79 0
13064 220498 1 NOH15C18 ABC15D18 45.85 1.0 -8.49 -0.74 0
13065 220567 1 O3H16C25 A3B16C25 -7.74 1.2 -8.95 -1.4 0
13066 220588 2 N2C13H15 A2B13C15 102.91 5.25 -8.01 0.39 0
13067 220591 1 NSH7C8 ABC7D8 38.55 2.3 -8.32 -0.2 0
13068 220643 1 ClSO2C8H9 ABC2D8E9 -79.41 5.43 -9.96 -0.84 0
13069 220661 1 NOC12H21 ABC12D21 -76.71 4.29 -9.56 1.4 0
13070 220678 1 NO3C14H15 AB3C14D15 -78.32 6.18 -9.26 -1.14 0
13071 220693 1 ClNO3H10C12 ABC3D10E12 -104.92 2.86 -9.06 -1.29 0
13072 220697 1 OSN4H14C16 ABC4D14E16 58.0 4.34 -8.48 -0.83 0
13073 220726 2 OC9H9 AB9C9 -67.25 2.54 -8.82 -0.62 0
13074 220728 1 OC22H28 AB22C28 -57.5 3.32 -8.74 0.24 0
13075 220758 1 SN4H8C11 AB4C8D11 113.8 1.96 -9.14 -1.28 0
13076 220766 1 NO2C9H11 AB2C9D11 -65.66 4.06 -8.6 0.06 0
13077 220772 1 NO6H13C16 AB6C13D16 -129.29 7.74 -7.38 -2.57 0
13078 220780 1 ClN5C7H8 AB5C7D8 71.43 3.36 -9.06 -0.63 0
13079 220849 1 NO3H13C15 AB3C13D15 -9.5 5.25 -9.74 -1.5 0
13080 220905 1 N3C12H13 A3B12C13 42.58 0.9 -9.06 0.03 0
13081 220908 1 SO4N6C15H20 AB4C6D15E20 -102.06 8.47 -8.66 -0.36 0
13082 220963 1 Br2O2C5H6 A2B2C5D6 -63.11 1.68 -10.6 -0.91 0
13083 220999 1 SN2O4C5H6 AB2C4D5E6 -115.25 3.54 -10.56 -1.12 0
13084 221004 1 SCl2O2H6C10 AB2C2D6E10 -52.05 5.23 -9.8 -1.78 0
13085 221006 1 SO3C10H22 AB3C10D22 -171.63 1.86 -9.33 0.4 0
13086 221012 1 Br2O3H8C13 A2B3C8D13 -70.78 3.62 -9.32 -1.21 0
13087 221018 1 NSO2C15H17 ABC2D15E17 -54.77 6.11 -8.99 -0.45 0
13088 221031 1 NC11H17 AB11C17 -5.58 1.48 -8.23 0.53 0
13089 221054 1 O3C12H16 A3B12C16 -122.21 7.33 -10.04 -0.17 0
13090 221060 1 BN3O4H26C27 AB3C4D26E27 -125.25 3.72 -8.51 -0.32 0
13091 221090 1 N5C9H13 A5B9C13 59.07 2.62 -8.83 -0.31 0
13092 221093 1 N5C7H9 A5B7C9 64.59 1.31 -8.92 -0.27 0
13093 221094 1 ON5C6H7 AB5C6D7 44.02 7.76 -9.44 -1.22 0
13094 221102 1 ON5C11H11 AB5C11D11 66.45 4.52 -8.58 -0.61 0
13095 221158 1 N5C6H7 A5B6C7 76.68 3.73 -9.06 -0.51 0
13096 221159 1 N5C7H9 A5B7C9 78.57 3.86 -8.91 -0.5 0
13097 221228 1 N2O3C20H20 A2B3C20D20 -82.33 5.31 -9.32 -0.11 0
13098 221229 1 N3O4C22H33 A3B4C22D33 -149.32 3.3 -7.8 -1.33 0