List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
79152 49747134 2 ON3C9H9 AB3C9D9 82.99 3.21 -9.34 -1.31 0
79153 49747139 1 O2N6C13H16 A2B6C13D16 44.8 1.99 -9.93 -1.42 0
79154 49747141 1 ON5H15C16 AB5C15D16 122.33 2.85 -9.5 -1.31 0
79155 49747144 1 ON5C17H17 AB5C17D17 116.29 2.72 -9.42 -1.25 0
79156 49747146 1 ON5C17H17 AB5C17D17 113.39 2.5 -9.26 -1.32 0
79157 49747147 1 ClON5H14C16 ABC5D14E16 112.09 3.41 -9.48 -1.38 0
79158 49747155 1 O4N5H15C16 A4B5C15D16 13.34 3.85 -9.81 -1.44 0
79159 49747164 1 O3N5H17C18 A3B5C17D18 37.83 1.59 -9.73 -1.14 0
79160 49747174 1 OF2N5H13C16 AB2C5D13E16 30.14 3.18 -9.76 -1.4 0
79161 49747177 2 ON3C8H10 AB3C8D10 31.81 4.14 -9.83 -1.42 0
79162 49747179 1 ClO2N6H13C16 AB2C6D13E16 71.6 5.33 -9.23 -1.53 0
79163 49747180 1 ClO2N6H13C16 AB2C6D13E16 71.17 4.39 -8.99 -1.48 0
79164 49747184 1 FO2N6H13C16 AB2C6D13E16 34.0 4.16 -9.06 -1.53 0
79165 49747197 1 O2N6H16C17 A2B6C16D17 77.86 3.42 -9.64 -1.46 0
79166 49747198 2 O2N3C9H9 A2B3C9D9 6.13 3.41 -8.86 -1.4 0
79167 49747199 1 ClO2N6H13C16 AB2C6D13E16 72.86 2.25 -9.1 -1.49 0
79168 49747204 1 O3N6C19H20 A3B6C19D20 31.23 2.63 -8.83 -1.42 0
79169 49747207 1 O2F3N6H13C17 A2B3C6D13E17 -82.39 6.28 -9.57 -1.6 0
79170 49747209 1 O2F3N6H13C17 A2B3C6D13E17 -79.05 1.51 -9.5 -1.38 0
79171 49747218 1 ClO3N6H15C17 AB3C6D15E17 33.36 4.78 -8.79 -1.46 0
79172 49747219 1 O3N6C20H22 A3B6C20D22 26.71 5.38 -8.33 -1.18 0
79173 49747224 1 FO2N3C25H26 AB2C3D25E26 -25.39 4.46 -8.53 -0.57 0
79174 49747225 1 FO3N4C23H25 AB3C4D23E25 -88.36 5.78 -8.48 -1.17 0
79175 49747228 1 ClFSO2N3C21H21 ABCD2E3F21G21 -38.91 3.27 -8.4 -1.11 0
79176 49747229 1 FN4O4H23C24 AB4C4D23E24 -43.12 3.84 -8.4 -1.11 0
79177 49747233 1 FN4O4C25H25 AB4C4D25E25 -29.88 4.65 -8.61 -1.6 0
79178 49747237 1 FO4N7C25H28 AB4C7D25E28 -111.38 4.57 -8.33 -0.92 0
79179 49747239 1 FSO2N3C27H32 ABC2D3E27F32 -56.66 4.67 -8.44 -0.31 0
79180 49747241 1 FN3O4C29H34 AB3C4D29E34 -132.08 7.34 -8.31 -0.08 0
79181 49747261 1 FO4N5C28H30 AB4C5D28E30 -125.67 1.78 -8.37 -0.73 0
79182 49747280 1 Cl2N3O3C24H25 A2B3C3D24E25 -49.71 2.67 -7.79 -1.03 0
79183 49747288 1 SN3O3C28H35 AB3C3D28E35 -49.55 2.67 -8.26 -0.35 0
79184 49747290 1 N3O5C30H37 A3B5C30D37 -121.95 5.19 -8.7 0.04 0
79185 49747291 1 N3O5C30H37 A3B5C30D37 -123.62 3.49 -8.59 -0.05 0
79186 49747293 1 FN3O3C27H30 AB3C3D27E30 -66.56 2.06 -8.22 -0.32 0
79187 49747295 1 O3N4C22H26 A3B4C22D26 -9.81 2.84 -8.04 0.15 0
79188 49747318 1 O3N4C21H28 A3B4C21D28 -42.34 3.84 -7.8 0.28 0
79189 49747320 1 SN3O4C19H27 AB3C4D19E27 -176.74 6.28 -9.36 -0.64 0
79190 49747325 1 SN3O4C21H27 AB3C4D21E27 -130.78 4.0 -9.23 -0.69 0
79191 49747331 1 SO3N4C22H26 AB3C4D22E26 -71.95 10.37 -9.08 -0.64 0
79192 49747333 1 SN3O4C22H31 AB3C4D22E31 -129.93 8.56 -9.29 -0.47 0
79193 49747338 1 SO3N4C23H28 AB3C4D23E28 -73.67 13.5 -8.6 -0.82 0
79194 49747345 1 ClSN2O3C23H27 ABC2D3E23F27 -92.54 5.46 -9.22 -0.64 0
79195 49747356 1 SO3N4C25H30 AB3C4D25E30 -60.57 5.18 -9.34 -0.55 0
79196 49747368 1 SN3O5C26H31 AB3C5D26E31 -179.93 7.61 -9.2 -1.46 0
79197 49747369 1 SN4O5C26H32 AB4C5D26E32 -135.13 10.67 -7.93 -0.64 0
79198 49747370 1 BrSN3O4C25H30 ABC3D4E25F30 -146.09 9.64 -8.7 -0.75 0
79199 49747374 1 SN2O5C27H36 AB2C5D27E36 -188.46 3.17 -8.94 -0.43 0
79200 49747387 1 BrN2S3O4C18H23 AB2C3D4E18F23 -115.41 7.29 -9.28 -1.03 0
79201 49747388 1 SN4O4C21H26 AB4C4D21E26 -121.75 8.92 -9.19 -0.62 0
79202 49747389 1 SF3N3O4C23H26 AB3C3D4E23F26 -292.35 10.61 -9.39 -0.71 0
79203 49747395 2 SN2O3C13H17 AB2C3D13E17 -219.34 10.84 -8.39 -0.55 0
79204 49747407 1 S2N4O5C30H34 A2B4C5D30E34 -146.65 3.04 -8.4 -0.63 0
79205 49747411 1 SN4O5C28H34 AB4C5D28E34 -188.59 3.43 -8.37 -0.67 0
79206 49747415 1 S2N3O4C18H23 A2B3C4D18E23 -127.52 9.11 -9.31 -0.96 0
79207 49747416 1 S2N4O4C17H22 A2B4C4D17E22 -101.77 1.66 -9.44 -1.06 0
79208 49747420 1 S2N3O5C19H21 A2B3C5D19E21 -81.17 4.04 -9.45 -0.98 0
79209 49747421 1 N3O3S3C19H21 A3B3C3D19E21 -49.57 7.73 -9.26 -1.04 0
79210 49747423 1 S2N3O3C22H25 A2B3C3D22E25 -47.44 6.88 -8.88 -1.09 0
79211 49747430 1 N2S2O4C25H26 A2B2C4D25E26 -88.46 3.14 -9.14 -0.88 0
79212 49747440 1 N2O3S3C18H22 A2B3C3D18E22 -60.38 2.5 -9.09 -0.91 0
79213 49747444 1 F2N2S3O4C17H20 A2B2C3D4E17F20 -201.44 7.85 -9.63 -1.14 0
79214 49747449 1 S2N3O4C13H19 A2B3C4D13E19 -143.3 6.31 -9.59 -1.08 0
79215 49747452 1 S2N4O5C23H28 A2B4C5D23E28 -162.37 4.08 -8.67 -0.95 0
79216 49747455 1 S2N4O5C26H34 A2B4C5D26E34 -178.85 6.94 -8.58 -0.89 0
79217 49747456 1 S3N4O6C23H30 A3B4C6D23E30 -210.4 6.05 -8.57 -0.96 0
79218 49747464 1 FN4O4C26H27 AB4C4D26E27 -115.37 6.29 -8.54 -0.98 0
79219 49747465 1 FSN3O3C26H26 ABC3D3E26F26 -52.88 5.43 -8.6 -1.09 0
79220 49747469 1 ClFN3O3H27C28 ABC3D3E27F28 -64.39 4.45 -8.32 -0.61 0
79221 49747479 1 F2N3O4C31H33 A2B3C4D31E33 -169.41 4.94 -8.87 -0.24 0
79222 49747528 1 FN4O4C27H33 AB4C4D27E33 -181.68 4.83 -8.62 -0.51 0
79223 49747529 1 FSN4O5C24H29 ABC4D5E24F29 -209.89 3.3 -8.75 -0.79 0
79224 49747534 1 SN2O3C17H20 AB2C3D17E20 -46.98 4.63 -8.88 -0.66 0
79225 49747541 1 SN3O4C19H21 AB3C4D19E21 -18.54 4.93 -9.24 -1.82 0
79226 49747543 1 SO4N6C19H24 AB4C6D19E24 -97.83 2.95 -9.03 -0.91 0
79227 49747553 1 S2N3O3C15H19 A2B3C3D15E19 -49.44 2.79 -9.03 -1.07 0
79228 49747565 1 S3N4O5C25H28 A3B4C5D25E28 -113.43 6.1 -8.51 -1.14 0
79229 49747571 1 N2O2C17H20 A2B2C17D20 -12.34 2.47 -8.76 -0.8 0
79230 49747579 1 N3O3C18H19 A3B3C18D19 4.79 2.01 -8.95 -1.03 0
79231 49747588 1 FN2O2C22H27 AB2C2D22E27 -93.57 3.31 -9.04 -0.3 0
79232 49747589 1 N2O3C23H30 A2B3C23D30 -87.22 5.04 -8.88 -0.1 0
79233 49747591 1 OSN2C18H22 ABC2D18E22 25.09 3.35 -8.88 -0.32 0
79234 49747596 1 OSN2C17H22 ABC2D17E22 2.11 3.86 -8.97 -0.17 0
79235 49747600 1 SF2N2O2C16H18 AB2C2D2E16F18 -114.01 4.95 -9.18 -1.0 0
79236 49747605 1 SO2N3C17H21 AB2C3D17E21 -25.5 1.58 -8.88 -0.4 0
79237 49747606 1 O3N4C22H26 A3B4C22D26 -77.51 2.04 -8.68 -0.36 0
79238 49747607 1 O3N4C23H28 A3B4C23D28 -84.77 6.3 -8.62 -0.47 0
79239 49747609 1 O3N4C25H32 A3B4C25D32 -91.51 3.78 -8.5 -0.32 0
79240 49747611 1 S2N4O4C25H28 A2B4C4D25E28 -78.06 4.89 -8.63 -1.01 0
79241 49747615 1 SN2O3C19H24 AB2C3D19E24 -78.54 2.52 -8.7 -0.45 0
79242 49747617 1 N3O4C20H25 A3B4C20D25 -121.29 8.17 -8.56 -0.94 0
79243 49747618 1 N4O4C19H26 A4B4C19D26 -92.25 4.91 -8.7 0.2 0
79244 49747621 1 N3O5C22H25 A3B5C22D25 -64.44 3.97 -9.06 -1.64 0
79245 49747623 1 FN2O4C25H31 AB2C4D25E31 -173.11 4.62 -9.06 -0.16 0
79246 49747625 1 N2O5C26H34 A2B5C26D34 -165.23 6.88 -8.8 -0.11 0
79247 49747626 1 SN2O3C21H26 AB2C3D21E26 -56.74 3.73 -8.43 -0.13 0
79248 49747627 2 NO2C12H15 AB2C12D15 -102.02 6.42 -8.59 -0.04 0
79249 49747631 1 SN2O4C21H26 AB2C4D21E26 -93.04 7.35 -8.74 -0.92 0
79250 49747645 1 N4O5C27H32 A4B5C27D32 -170.59 6.22 -8.29 -0.58 0
79251 49747682 1 SO3N4C22H26 AB3C4D22E26 -84.53 3.36 -8.34 -0.68 0