List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
354385 127286629 2 ON2C11H16 AB2C11D16 -91.39 6.46 -8.68 0.02 0
354386 127286630 1 ON5C21H29 AB5C21D29 7.12 4.48 -8.92 -0.66 0
354387 127286631 1 O2N5C22H31 A2B5C22D31 -35.68 4.14 -8.71 -0.55 0
354388 127286632 1 OCl2N5C15H21 AB2C5D15E21 -6.98 4.74 -8.84 -0.62 0
354389 127286633 1 O2N3C17H31 A2B3C17D31 -110.56 4.69 -8.97 1.31 0
354390 127286634 1 ON5C20H27 AB5C20D27 8.07 6.5 -8.84 -0.53 0
354391 127286635 1 SO3N4C17H24 AB3C4D17E24 -111.23 3.53 -9.47 -0.91 0
354392 127286636 1 SO2N4C16H24 AB2C4D16E24 -64.09 1.0 -8.83 -0.88 0
354393 127286637 1 SO3N4C13H18 AB3C4D13E18 -91.33 4.24 -9.58 -0.97 0
354394 127286638 1 SO2N4C15H22 AB2C4D15E22 -38.6 0.71 -8.77 -0.88 0
354395 127286639 1 SO2N4C18H28 AB2C4D18E28 -77.58 1.22 -8.84 -0.87 0
354396 127286640 1 SO3N4C19H30 AB3C4D19E30 -118.98 4.87 -9.09 -0.94 0
354397 127286641 1 SO2N4C17H26 AB2C4D17E26 -68.85 0.58 -9.0 -0.78 0
354398 127286642 1 ON6C18H32 AB6C18D32 -22.25 4.23 -8.72 0.47 0
354399 127286643 1 O2N4C21H34 A2B4C21D34 -81.26 3.26 -8.6 0.47 0
354400 127286644 1 N3O3C20H31 A3B3C20D31 -122.4 3.05 -8.78 0.48 0
354401 127286645 1 N3O3C14H19 A3B3C14D19 -112.83 6.28 -9.38 0.24 0
354402 127286646 1 N3O3C20H31 A3B3C20D31 -126.72 2.78 -9.05 0.44 0
354403 127286647 1 ON5C19H31 AB5C19D31 -36.48 4.73 -8.56 0.09 0
354404 127286648 2 ON2C9H15 AB2C9D15 -85.38 4.02 -9.04 0.97 0
354405 127286649 1 OSN4C14H22 ABC4D14E22 -4.35 4.81 -8.91 -0.81 0
354406 127286650 1 O3N4C19H32 A3B4C19D32 -126.46 4.3 -8.91 0.63 0
354407 127286651 1 O2N4C17H30 A2B4C17D30 -96.41 5.85 -8.98 0.99 0
354408 127286652 1 O2N4C15H28 A2B4C15D28 -78.69 2.68 -8.78 1.09 0
354409 127286653 1 ON4C15H24 AB4C15D24 -14.06 2.55 -8.99 0.85 0
354410 127286654 1 O2N3C15H27 A2B3C15D27 -97.61 4.87 -8.95 1.22 0
354411 127286655 1 N3O3C22H35 A3B3C22D35 -145.38 3.01 -8.78 0.68 0
354412 127286656 2 ON2C7H13 AB2C7D13 -102.53 3.4 -8.76 0.93 0
354413 127286657 1 O2N5C19H29 A2B5C19D29 -88.68 5.08 -8.81 0.93 0
354414 127286658 1 ON5C18H31 AB5C18D31 -52.55 5.15 -8.44 0.98 0
354415 127286659 1 ON5C18H29 AB5C18D29 -38.02 4.98 -8.61 0.93 0
354416 127286660 1 N3O3C17H31 A3B3C17D31 -162.78 3.56 -8.97 1.4 0
354417 127286661 3 NOC4H7 ABC4D7 -149.18 7.14 -9.56 0.92 0
354418 127286862 1 ON3C15H25 AB3C15D25 -56.8 4.33 -9.57 1.03 0
354419 127286863 1 O2N3C14H25 A2B3C14D25 -122.87 6.3 -9.53 0.77 0
354420 127286864 1 O2N3C19H35 A2B3C19D35 -133.55 4.6 -9.01 1.39 0
354421 127286865 1 ON3C15H25 AB3C15D25 -52.44 5.22 -9.42 1.04 0
354422 127286866 1 O2N3C14H25 A2B3C14D25 -122.1 6.46 -9.51 0.8 0
354423 127286867 1 FO2N4C20H29 AB2C4D20E29 -131.15 1.94 -8.88 -0.58 0
354424 127286868 1 O2N3C16H21 A2B3C16D21 -82.4 3.28 -9.26 0.11 0
354425 127286869 1 ON5C21H29 AB5C21D29 1.25 6.42 -8.96 -0.64 0
354426 127286870 1 O2N4C17H34 A2B4C17D34 -117.82 4.58 -8.51 1.3 0
354427 127286871 1 O2N3C22H35 A2B3C22D35 -99.68 5.7 -8.72 0.1 0
354428 127286872 1 O2N3C23H37 A2B3C23D37 -99.4 3.81 -8.59 0.3 0
354429 127286873 1 ClO2N3C21H32 AB2C3D21E32 -101.89 2.5 -8.56 -0.41 0
354430 127286874 1 N3O4C20H27 A3B4C20D27 -152.45 6.54 -8.91 -0.28 0
354431 127286875 1 OSN5C18H31 ABC5D18E31 -34.04 3.28 -8.6 -0.68 0
354432 127286876 2 ON2C10H14 AB2C10D14 -74.41 4.17 -8.77 -0.14 0
354433 127286877 2 ON2C10H15 AB2C10D15 -77.47 2.43 -8.75 0.02 0
354434 127286878 1 SO3N4C19H30 AB3C4D19E30 -99.45 4.95 -8.92 -0.1 0
354435 127286879 1 O3N4C20H28 A3B4C20D28 -94.11 4.19 -8.71 -0.16 0
354436 127286880 1 SN4O4C17H32 AB4C4D17E32 -195.95 6.4 -9.07 0.68 0
354437 127286881 1 SN4O4C15H30 AB4C4D15E30 -192.96 5.95 -8.78 0.41 0
354438 127286882 1 SN4O4C16H28 AB4C4D16E28 -198.51 3.94 -9.42 0.51 0
354439 127286883 1 SO3N4C14H28 AB3C4D14E28 -127.17 6.76 -9.08 0.56 0
354440 127286884 1 SN4O4C14H28 AB4C4D14E28 -180.69 4.95 -9.07 0.42 0
354441 127286885 1 SO3N4C15H28 AB3C4D15E28 -148.48 4.05 -8.86 0.53 0
354442 127286886 1 SN4O4C12H22 AB4C4D12E22 -188.27 2.42 -9.58 0.38 0
354443 127286887 1 SO3N4C14H26 AB3C4D14E26 -119.39 2.49 -8.98 0.5 0
354444 127286888 1 SO3N5C17H35 AB3C5D17E35 -144.54 5.21 -8.76 0.38 0
354445 127286889 1 SO3N4C17H32 AB3C4D17E32 -160.43 3.42 -8.57 0.58 0
354446 127286890 1 SO3N4C16H32 AB3C4D16E32 -159.95 6.03 -8.99 0.43 0
354447 127286891 1 SO3N4C16H30 AB3C4D16E30 -153.14 3.15 -8.79 0.57 0
354448 127286892 1 FON5C19H24 ABC5D19E24 -31.51 4.31 -8.93 -1.03 0
354449 127286893 1 FON5C21H28 ABC5D21E28 -49.78 6.57 -9.15 -0.76 0
354450 127286894 1 FON5C20H26 ABC5D20E26 -42.65 3.97 -8.92 -0.97 0
354451 127286895 1 FON5C22H30 ABC5D22E30 -57.17 6.63 -8.69 -0.72 0
354452 127286896 1 FON5C21H28 ABC5D21E28 -46.55 5.12 -8.82 -0.84 0
354453 127286897 1 FO2N4C21H25 AB2C4D21E25 -68.43 7.29 -8.96 -0.64 0
354454 127286898 1 O2N3C19H35 A2B3C19D35 -131.36 4.43 -9.07 1.49 0
354455 127286899 1 ON3C15H25 AB3C15D25 -55.34 4.27 -9.54 1.01 0
354456 127286900 1 O2N3C14H25 A2B3C14D25 -122.45 3.64 -9.56 0.86 0
354457 127286901 1 O2N3C21H33 A2B3C21D33 -95.24 3.86 -8.55 0.34 0
354458 127286902 1 O3N4C16H24 A3B4C16D24 -100.25 7.08 -9.49 0.01 0
354459 127286903 1 O2N5C19H33 A2B5C19D33 -59.5 4.38 -8.67 0.06 0
354460 127286904 1 O3N4C12H18 A3B4C12D18 -90.81 5.86 -9.79 -0.08 0
354461 127286905 2 ON2C7H11 AB2C7D11 -23.65 4.74 -8.78 0.02 0
354462 127286906 1 O2N5C17H31 A2B5C17D31 -50.92 6.37 -8.28 0.02 0
354463 127286907 1 N3O3C17H31 A3B3C17D31 -159.61 2.66 -9.07 1.32 0
354464 127286908 1 N3O3C15H29 A3B3C15D29 -158.38 3.56 -8.72 1.19 0
354465 127286909 1 N3O3C16H27 A3B3C16D27 -156.72 5.86 -9.34 1.05 0
354466 127286910 1 N3O4C17H29 A3B4C17D29 -192.45 4.43 -9.1 0.71 0
354467 127286911 1 O2N3C15H29 A2B3C15D29 -123.52 3.48 -8.53 1.26 0
354468 127287017 1 ON7C18H33 AB7C18D33 -16.76 4.72 -8.56 0.46 0
354469 127287018 1 ON6C13H22 AB6C13D22 22.16 5.4 -8.96 0.19 0
354470 127287019 1 ON6C16H28 AB6C16D28 -21.07 3.05 -8.89 0.19 0
354471 127287020 1 O2N6C17H30 A2B6C17D30 -63.25 3.63 -9.13 0.17 0
354472 127287021 1 ON6C15H26 AB6C15D26 -13.74 2.46 -8.84 0.21 0
354473 127287022 1 O2N5C21H31 A2B5C21D31 -64.49 3.93 -8.17 0.4 0
354474 127287023 1 O2N5C16H25 A2B5C16D25 -74.27 9.58 -8.84 0.8 0
354475 127287024 1 O2N5C12H19 A2B5C12D19 -64.32 6.73 -9.03 0.25 0
354476 127287025 1 ON4C20H28 AB4C20D28 -26.7 3.0 -8.36 0.11 0
354477 127287026 1 O2N4C23H34 A2B4C23D34 -84.19 3.86 -8.49 -0.04 0
354478 127287027 1 ON4C21H30 AB4C21D30 -30.2 2.48 -8.32 0.13 0
354479 127287028 1 O2N3C23H25 A2B3C23D25 -24.24 6.95 -9.21 -0.79 0
354480 127287029 1 O2N5C20H25 A2B5C20D25 -35.22 1.85 -8.96 -0.24 0
354481 127287030 1 O2N3C17H25 A2B3C17D25 -81.96 3.14 -8.78 0.43 0
354482 127287031 1 ON3C17H21 AB3C17D21 -13.96 5.09 -9.21 0.33 0
354483 127287032 1 O2N3C16H21 A2B3C16D21 -83.16 5.88 -9.3 0.26 0
354484 127287033 2 ON2C10H15 AB2C10D15 -54.06 3.25 -8.95 -0.23 0