List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
11164 111543 1 NSO4C13H20 ABC4D13E20 -86.48 7.69 0.0 0.0 -1
11165 111544 1 SC4O4N5H9 AB4C4D5E9 -144.47 4.71 -10.09 -1.09 0
11166 111545 1 NaO2H3N4C5 AB2C3D4E5 -84.44 7.6 -8.5 0.16 0
11167 111547 1 OC13H16 AB13C16 -34.54 4.7 -9.43 -0.48 0
11168 111550 1 TiO8C38H70 AB8C38D70 -449.7 12.83 -7.34 -1.02 0
11169 111551 3 OC6H10 AB6C10 -126.43 6.92 -9.79 0.63 0
11170 111552 1 ON2H16C18 AB2C16D18 48.42 0.62 -8.52 -1.18 0
11171 111553 1 ClON2C16H25 ABC2D16E25 -20.3 10.16 -8.5 -0.73 0
11172 111563 1 ClNO3C9H10 ABC3D9E10 -117.67 3.15 -9.45 -0.83 0
11173 111566 1 N4S4C27H28 A4B4C27D28 104.8 3.34 -8.34 -0.22 0
11174 111567 1 N4C7H18 A4B7C18 8.04 0.94 -8.88 2.29 0
11176 111573 1 S3O4N5H39C40 A3B4C5D39E40 9.99 10.13 -8.13 -1.44 0
11177 111574 1 S3O4N5C40H40 A3B4C5D40E40 52.58 7.85 0.0 0.0 1
11178 111575 1 O2N3S3C20H29 A2B3C3D20E29 -51.16 8.15 -8.23 -0.77 0
11179 111576 1 N2O2S3C14H14 A2B2C3D14E14 -26.12 8.65 -8.37 -0.86 0
11180 111585 3 OC6H10 AB6C10 -127.78 4.99 -9.76 0.55 0
11181 111592 1 ClNH16C17 ABC16D17 55.18 7.16 -8.7 -1.09 0
11182 111593 1 NH16C17 AB16C17 62.49 2.49 0.0 0.0 1
11183 111596 1 NO3C11H15 AB3C11D15 -107.95 1.92 -9.34 -0.77 0
11184 111600 1 BrSN2C13H29 ABC2D13E29 -52.39 2.73 -8.7 0.43 0
11185 111602 1 NNaO2S2C7H12 ABC2D2E7F12 -124.11 9.46 -8.84 -0.52 0
11186 111604 2 NC7H8 AB7C8 95.35 2.15 -9.51 -0.08 2
11187 111609 2 OC4H7 AB4C7 -97.29 2.19 -10.56 -0.08 0
11188 111610 1 O2C11H18 A2B11C18 -25.66 2.16 -10.15 0.0 0
11189 111616 1 PO7C8H21 AB7C8D21 -403.56 4.92 -9.95 0.76 0
11190 111624 1 Cl2C21H34 A2B21C34 -73.3 1.03 -9.21 -0.3 0
11192 111655 1 O5C13H28 A5B13C28 -276.19 4.16 -10.29 0.58 0
11193 111689 1 S2O7C14H26 A2B7C14D26 -314.42 3.83 -9.22 0.13 0
11194 111690 1 NSCl2O6H7C12 ABC2D6E7F12 -120.97 4.7 -9.76 -1.69 0
11195 111695 1 NSO3C16H19 ABC3D16E19 -91.34 3.03 -8.22 -0.74 0
11196 111706 1 OC14H28 AB14C28 -91.64 2.06 -9.71 1.1 0
11197 111716 1 N2O3C40H80 A2B3C40D80 -300.83 5.33 -9.36 0.57 0
11198 111729 1 S3N4C8H20 A3B4C8D20 22.4 4.1 -8.5 -0.47 0
11199 111740 1 O4C15H20 A4B15C20 -173.89 6.65 -10.59 -1.24 0
11200 111781 1 SO2C7H8 AB2C7D8 -39.28 1.86 -8.57 0.02 0
11201 111782 1 SN4O6C18H30 AB4C6D18E30 -216.89 5.66 -9.36 -0.93 0
11202 111819 1 Cl2N4C42H59 A2B4C42D59 269.04 3.09 0.0 0.0 -1
11203 111820 2 N2C21H29 A2B21C29 118.27 3.68 -8.05 -1.42 0
11205 111822 2 SN2O3C10H13 AB2C3D10E13 -130.37 8.45 -8.34 -2.12 0
11206 111832 2 O5C14H29 A5B14C29 -565.11 4.84 -10.94 0.65 0
11207 111882 1 NC19H41 AB19C41 -91.89 1.99 -9.25 3.56 0
11208 111885 1 O3C15H32 A3B15C32 -205.64 1.8 -10.24 1.45 0
11209 111899 2 SN3O3C28H29 AB3C3D28E29 -0.67 4.01 -7.91 -1.75 0
11210 111900 1 ClPSN3O3C10H19 ABCD3E3F10G19 -181.59 2.15 -9.37 -0.18 0
11211 111901 1 BrO2N3C6H6 AB2C3D6E6 12.29 4.6 -9.59 -1.42 0
11212 111906 1 ClSN2O2C11F11H16 ABC2D2E11F11G16 -640.96 10.58 -8.53 -1.54 0
11213 111908 1 ISN2O2C11F11H16 ABC2D2E11F11G16 -622.67 11.49 -7.57 -1.21 0
11214 111933 1 Na2S2N6O9H24C28 A2B2C6D9E24F28 -222.75 41.88 -8.05 -1.97 0
11215 111934 1 S2N6O9H26C28 A2B6C9D26E28 -180.22 12.96 -8.64 -1.65 0
11216 111999 1 O2C11H24 A2B11C24 -138.24 2.96 -9.89 1.9 0
11217 112005 2 OC5H8 AB5C8 -90.76 4.63 -9.56 0.46 0
11218 112033 1 O3C13H22 A3B13C22 -129.39 3.66 -9.96 0.86 0
11219 112039 1 O5C8H12 A5B8C12 -223.15 4.04 -10.56 0.27 0
11220 112051 1 O2C17H24 A2B17C24 -85.49 1.68 -9.53 -0.56 0
11221 112057 1 N2O3C11H26 A2B3C11D26 -169.66 3.33 -8.82 2.01 0
11222 112065 1 OC10H20 AB10C20 -92.49 2.05 -10.34 2.95 0
11223 112067 1 OC15H30 AB15C30 -114.4 1.97 -10.13 3.0 0
11224 112076 1 SN3O3C22H37 AB3C3D22E37 -121.63 7.56 -8.67 -0.35 0
11225 112077 1 O5C24H30 A5B24C30 -147.33 7.3 -8.71 -0.38 0
11226 112108 1 NNaSO5H10C14 ABCD5E10F14 -130.07 15.0 -10.01 -1.66 0
11228 112124 1 N2O6C19H20 A2B6C19D20 -140.72 8.29 -9.94 -1.43 0
11229 112125 1 CuSN2O8C14H32 ABC2D8E14F32 -327.37 10.64 0.0 0.0 0
11230 112131 1 N4O7C28H46 A4B7C28D46 -348.84 3.5 -10.06 0.14 0
11231 112141 1 NO7C22H37 AB7C22D37 -361.26 7.77 -8.78 0.15 0
11232 112173 1 N2O5C32H34 A2B5C32D34 -139.8 8.19 -8.15 -1.14 0
11233 112189 1 SN3O4C23H29 AB3C4D23E29 -108.66 6.21 -8.23 -1.05 0
11234 112193 1 O6C29H36 A6B29C36 -210.05 1.08 -8.66 -0.48 0
11235 112198 1 NaSO5C18H29 ABC5D18E29 -269.27 5.91 -8.57 0.4 0
11236 112215 1 NC11H13 AB11C13 31.77 3.08 -9.68 0.03 0
11237 112218 1 OC13H20 AB13C20 -30.73 2.22 -9.4 0.95 0
11238 112238 1 O2N6C21H26 A2B6C21D26 61.02 4.86 -8.53 -1.07 0
11239 112308 1 S2O7C32H50 A2B7C32D50 -335.91 7.76 -9.76 -0.77 0
11240 112339 1 N3C26H49 A3B26C49 -86.26 1.29 -8.64 3.17 0
11242 112344 1 N2O3H16C18 A2B3C16D18 -59.49 8.03 -8.62 -1.07 0
11243 112387 1 SN5O5H25C27 AB5C5D25E27 -31.04 6.04 -9.09 -1.79 0