List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
323438 126674825 1 N2O3C18H28 A2B3C18D28 -146.55 3.98 -9.85 -0.13 0
323439 126674826 1 N2O5C19H28 A2B5C19D28 -224.96 5.03 -9.5 -1.08 0
323440 126674828 1 O3N4C20H26 A3B4C20D26 -96.56 3.37 -9.82 -1.01 0
323441 126674830 1 F3N5O5C25H30 A3B5C5D25E30 -299.16 6.87 -9.05 -0.71 0
323442 126674831 1 F3N4O4C25H25 A3B4C4D25E25 -241.85 8.95 -8.84 -0.68 0
323443 126674832 1 O2F3N3C21H24 A2B3C3D21E24 -216.0 10.16 -9.11 -0.46 0
323444 126674839 1 ClO3N5C26H28 AB3C5D26E28 -67.22 2.69 -8.65 -1.14 0
323445 126674841 1 ClON6H15C19 ABC6D15E19 102.78 7.12 -8.63 -1.11 0
323446 126674843 1 ClNOC18H18 ABCD18E18 5.07 6.57 -9.38 -0.83 0
323447 126674846 1 O3N5H23C29 A3B5C23D29 39.85 10.64 -8.92 -1.05 0
323448 126674847 1 O3N4H22C32 A3B4C22D32 61.7 10.32 -8.93 -1.06 0
323449 126674849 1 FO2N3H14C22 AB2C3D14E22 40.86 8.06 -9.15 -0.82 0
323450 126674862 1 IOC8H13 ABC8D13 -47.63 3.86 -9.24 -0.62 0
323451 126674866 1 OC14H20 AB14C20 -52.99 1.08 -9.0 0.52 0
323452 126674869 1 OC15H20 AB15C20 -20.99 1.35 -9.27 0.35 0
323453 126674871 1 OC15H22 AB15C22 -57.94 2.21 -8.99 0.4 0
323454 126674874 1 O4N5C24H31 A4B5C24D31 -94.67 2.01 -8.44 -0.44 0
323455 126674876 1 OSC13H18 ABC13D18 -34.33 3.22 -8.42 -0.04 0
323456 126674877 1 O3C14H20 A3B14C20 -116.92 3.68 -8.76 0.43 0
323457 126674880 2 OC7H10 AB7C10 -89.2 2.56 -9.36 0.26 0
323458 126674881 1 O2N5C28H31 A2B5C28D31 14.65 2.36 -8.29 -0.39 0
323459 126674883 1 NOC13H19 ABC13D19 -36.98 2.99 -8.35 0.33 0
323460 126674885 1 OC18H20 AB18C20 -10.35 1.64 -9.15 0.18 0
323461 126674886 1 OC15H22 AB15C22 -52.51 1.25 -8.98 0.51 0
323462 126674894 1 O2N5C21H27 A2B5C21D27 -15.7 3.37 -8.22 -0.3 0
323463 126674896 2 ON3C12H16 AB3C12D16 -7.13 3.03 -8.12 -0.14 0
323464 126674901 1 O2C13H18 A2B13C18 -74.09 2.33 -8.62 0.36 0
323465 126674903 1 O3C14H18 A3B14C18 -118.31 1.7 -9.71 -0.53 0
323466 126674905 1 O2N6C15H22 A2B6C15D22 -43.32 3.24 -8.43 -0.67 0
323467 126674906 1 F2O3N4H16C27 A2B3C4D16E27 -34.18 5.14 -9.34 -1.06 0
323468 126674907 1 ON4C15H18 AB4C15D18 16.0 4.25 -9.61 -1.05 0
323469 126674913 1 N4H88C117 A4B88C117 426.88 3.75 -7.87 -0.57 0
323470 126674915 1 O2F3N3C20H22 A2B3C3D20E22 -208.42 3.93 -9.24 -0.58 0
323471 126674917 1 O2N6C19H28 A2B6C19D28 -58.59 1.72 -8.39 -0.63 0
323472 126674919 1 F3N4O4C26H29 A3B4C4D26E29 -251.37 7.14 -8.12 -0.94 0
323473 126674924 1 ON5C18H23 AB5C18D23 5.84 3.41 -8.38 -0.59 0
323474 126674929 1 N2O2C27H38 A2B2C27D38 -68.43 3.95 -8.39 0.04 0
323475 126674932 1 SO4F5N5C22H28 AB4C5D5E22F28 -362.7 9.52 -8.96 -0.76 0
323476 126674934 1 O3N5C29H29 A3B5C29D29 -7.79 6.6 -8.7 -0.69 0
323477 126674938 2 NC9H18 AB9C18 -42.22 3.02 -8.54 2.66 0
323478 126674939 1 NO2C24H31 AB2C24D31 -69.53 2.37 -8.92 0.11 0
323479 126674943 1 ON5C19H25 AB5C19D25 9.61 1.94 -8.78 -0.59 0
323480 126674945 1 NOC30H45 ABC30D45 -53.82 2.27 -8.33 0.0 0
323481 126674946 2 ON3C17H23 AB3C17D23 11.9 4.05 -8.27 -0.84 0
323482 126674947 1 O3N5C25H29 A3B5C25D29 -39.3 3.33 -8.65 -0.51 0
323483 126674948 1 O2C15H20 A2B15C20 -72.5 4.07 -9.21 0.28 0
323484 126674960 1 ON2H26C42 AB2C26D42 165.29 2.91 -7.85 -0.84 0
323485 126674973 1 ON2H14C18 AB2C14D18 49.09 2.58 -8.83 -0.91 0
323486 126674985 1 FO2N6C23H27 AB2C6D23E27 -43.54 0.73 -8.81 -0.65 0
323487 126674989 1 F2N3O5H27C29 A2B3C5D27E29 -180.17 7.41 -9.24 -1.36 0
323488 126675000 1 O3N8C35H44 A3B8C35D44 -11.66 3.61 -8.46 -0.35 0
323489 126675004 1 N4O10C21H42 A4B10C21D42 -470.29 7.93 -9.25 0.66 0
323490 126675011 1 N4O7C15H30 A4B7C15D30 -331.99 2.37 -9.46 0.72 0
323491 126675023 1 N2H38C49 A2B38C49 213.53 3.86 -7.86 -0.34 0
323492 126675029 1 SF2N3O5C31H31 AB2C3D5E31F31 -201.7 7.03 -8.6 -1.5 0
323493 126675030 1 N3O6C12H23 A3B6C12D23 -262.42 4.02 -9.62 0.47 0
323494 126675031 1 N3O7C17H35 A3B7C17D35 -345.78 3.88 -8.91 0.57 0
323495 126675032 1 N3O6C12H23 A3B6C12D23 -264.1 3.95 -9.61 0.2 0
323496 126675035 1 N3O10C20H39 A3B10C20D39 -480.81 1.09 -9.82 0.4 0
323497 126675036 1 SF2O3N7H21C25 AB2C3D7E21F25 -42.35 6.26 -9.56 -1.8 0
323498 126675037 1 N7O12C23H45 A7B12C23D45 -541.41 4.26 -9.59 0.38 0
323499 126675039 1 N3C5H9 A3B5C9 62.97 2.93 -8.43 -0.13 0
323500 126675041 1 ION2C3H7 ABC2D3E7 -30.62 4.46 -9.69 -1.11 0
323501 126675042 1 N6O10C19H38 A6B10C19D38 -445.61 5.83 -9.07 0.55 0
323502 126675049 1 F2O3N6H28C30 A2B3C6D28E30 -77.83 4.39 -9.66 -1.49 0
323503 126675050 1 F2O3N5H23C27 A2B3C5D23E27 -89.18 3.25 -9.24 -1.36 0
323504 126675055 1 SF2N3O6H29C30 AB2C3D6E29F30 -226.92 7.32 -9.68 -1.53 0
323505 126675056 1 F2S2N4O5H22C24 A2B2C4D5E22F24 -177.74 4.07 -9.36 -1.56 0
323506 126675057 1 F2N4O5H22C27 A2B4C5D22E27 -192.09 6.21 -9.53 -1.58 0
323507 126675058 1 SF2N3O4H27C29 AB2C3D4E27F29 -160.93 8.48 -9.0 -1.38 0
323508 126675063 2 NO2C15H17 AB2C15D17 -107.32 2.72 -9.38 -1.1 0
323509 126675065 1 OSC9H12 ABC9D12 -21.47 0.85 -8.65 0.2 0
323510 126675067 1 NSF2O2C23H23 ABC2D2E23F23 -144.91 3.73 -8.52 -1.0 0
323511 126675076 1 F2O3N7H23C29 A2B3C7D23E29 -25.82 6.76 -9.91 -1.86 0
323512 126675078 1 SF2N3O6C30H31 AB2C3D6E30F31 -251.14 9.05 -8.89 -0.99 0
323513 126675088 1 SF2N4O6C30H30 AB2C4D6E30F30 -238.03 7.26 -9.48 -1.66 0
323514 126675092 1 SF2N3O6H27C29 AB2C3D6E27F29 -240.06 5.0 -9.87 -1.48 0
323515 126675143 1 F2O3N6H22C26 A2B3C6D22E26 -65.92 6.2 -9.95 -1.57 0
323516 126675146 1 SF2N3O6C31H33 AB2C3D6E31F33 -261.03 14.71 -8.88 -1.2 0
323517 126675154 1 SN3O4C17H29 AB3C4D17E29 -208.99 4.16 -9.02 0.09 0
323518 126675171 1 OSN4C23H32 ABC4D23E32 -4.29 4.14 -8.32 -0.39 0
323519 126675173 1 OSN4C23H30 ABC4D23E30 31.02 3.44 -8.62 -0.36 0
323520 126675178 1 FON2C25H27 ABC2D25E27 -18.83 2.67 -8.65 -0.46 0
323521 126675184 1 N6C13H14 A6B13C14 109.46 3.35 -8.0 -0.92 0
323522 126675185 1 N3O4C18H27 A3B4C18D27 -182.79 6.03 -9.5 -0.78 0
323523 126675189 1 ON4C15H18 AB4C15D18 14.35 2.66 -9.54 -1.06 0
323524 126675211 1 O2N3C20H23 A2B3C20D23 -38.57 3.53 -9.4 -0.91 0
323525 126675213 1 ISO2N3C26H30 ABC2D3E26F30 11.12 6.22 -8.39 -2.64 0
323526 126675225 2 ON2C11H13 AB2C11D13 -5.37 5.98 -8.81 -0.9 0
323527 126675234 1 NO3C14H15 AB3C14D15 -71.91 4.73 -9.6 -1.48 0
323528 126675236 2 NOC5H8 ABC5D8 -62.9 6.04 -9.31 -0.39 0
323529 126675238 1 SO3N5H25C26 AB3C5D25E26 -17.84 3.88 -9.04 -1.18 0
323530 126675239 1 N2O5C17H20 A2B5C17D20 -163.17 2.16 -9.07 -1.11 0
323531 126675259 1 N3O3C24H29 A3B3C24D29 -82.46 2.82 -9.31 -1.03 0
323532 126675270 1 FN3O3C20H22 AB3C3D20E22 -142.26 2.5 -9.59 -1.14 0
323533 126675272 1 FN3O3C20H22 AB3C3D20E22 -141.54 2.38 -9.56 -1.08 0
323534 126675281 1 ClO2N5C22H24 AB2C5D22E24 -12.14 3.87 -8.71 -0.54 0
323535 126675287 1 N3O4C20H23 A3B4C20D23 -125.89 4.1 -9.59 -1.14 0
323536 126675288 1 BrOC13H17 ABC13D17 -39.69 3.57 -9.38 -0.07 0
323537 126675294 1 O3C14H18 A3B14C18 -109.38 1.43 -9.35 0.33 0