List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
136612 52074114 1 O3N4C30H38 A3B4C30D38 -64.04 2.84 -8.35 -0.24 1
136613 52074133 1 N3O3C22H32 A3B3C22D32 -88.76 6.85 0.0 0.0 0
136614 52074134 1 N3O3C22H31 A3B3C22D31 -107.57 3.43 -8.47 -0.34 1
136615 52074135 1 N3O3C23H34 A3B3C23D34 -85.91 6.18 0.0 0.0 0
136616 52074190 1 N3O5C29H37 A3B5C29D37 -150.07 3.61 -8.12 -0.4 1
136617 52074191 1 N3O5C26H30 A3B5C26D30 -104.64 6.78 0.0 0.0 1
136618 52074211 1 ClFN3O3C25H28 ABC3D3E25F28 -96.31 7.57 0.0 0.0 1
136619 52074585 1 N3O4C28H36 A3B4C28D36 -92.09 7.73 0.0 0.0 0
136620 52075028 1 N3O5C24H35 A3B5C24D35 -173.94 3.6 -8.3 -0.38 1
136621 52075029 1 N3O5C25H38 A3B5C25D38 -172.29 6.65 0.0 0.0 1
136622 52075031 1 N3O5C26H40 A3B5C26D40 -177.61 6.32 0.0 0.0 2
136623 52075043 1 N4O4C27H44 A4B4C27D44 -111.46 10.88 -5.76 0.02 0
136624 52075044 1 N4O4C27H42 A4B4C27D42 -139.13 5.8 -8.18 -0.23 1
136625 52075261 1 O3N4C26H33 A3B4C26D33 -45.99 4.58 0.0 0.0 1
136626 52075461 1 ClO2N4C28H34 AB2C4D28E34 -9.38 21.66 0.0 0.0 1
136627 52075807 1 ClSO2N4C20H26 ABC2D4E20F26 -22.3 9.84 0.0 0.0 0
136628 52075808 1 ClSO2N4C20H25 ABC2D4E20F25 -32.76 4.3 -8.87 -1.31 1
136629 52075809 1 ClSO2N4C20H26 ABC2D4E20F26 -26.96 12.18 0.0 0.0 0
136630 52075810 1 ClSO2N4C20H25 ABC2D4E20F25 -30.52 6.42 -8.82 -1.16 0
136631 52075860 1 OSCl2N4C19H22 ABC2D4E19F22 -1.24 4.53 -9.12 -1.17 0
136632 52076080 1 ClSO2N4C22H29 ABC2D4E22F29 -42.02 4.87 -8.9 -1.26 1
136633 52076335 1 ClOSN4C27H32 ABCD4E27F32 26.49 3.38 0.0 0.0 0
136634 52076391 1 SCl2O2N4C25H26 AB2C2D4E25F26 -13.57 3.33 -9.26 -1.39 1
136635 52076449 1 ClOSN4C29H38 ABCD4E29F38 16.73 18.66 0.0 0.0 0
136636 52076450 1 ClOSN4C29H37 ABCD4E29F37 -1.05 4.82 -8.86 -1.16 1
136637 52076451 1 ClOSN4C30H38 ABCD4E30F38 3.53 6.25 0.0 0.0 0
136638 52076452 1 ClOSN4C30H37 ABCD4E30F37 -1.1 5.38 -8.77 -1.23 0
136639 52076504 1 ClFOSN4C23H24 ABCDE4F23G24 -13.13 4.22 -8.98 -1.39 1
136640 52076521 1 FOSCl2N4C24H24 ABCD2E4F24G24 -8.92 8.74 0.0 0.0 1
136641 52077185 1 ClSO3N5C21H31 ABC3D5E21F31 -65.54 27.48 0.0 0.0 0
136642 52077272 1 SCl2O3N4C22H22 AB2C3D4E22F22 -39.47 6.22 -9.3 -1.79 0
136643 52077366 1 ClSO3N4C26H29 ABC3D4E26F29 -52.44 6.63 -9.17 -1.62 1
136644 52077367 1 ClSO3N4C26H30 ABC3D4E26F30 -47.73 26.13 0.0 0.0 0
136645 52077368 1 ClSO3N4C26H29 ABC3D4E26F29 -53.76 5.85 -9.14 -1.61 0
136646 52077496 1 F2N3O3H17C18 A2B3C3D17E18 -89.88 1.61 -9.11 -1.38 0
136647 52078303 1 FS2N3O5C23H28 AB2C3D5E23F28 -213.77 11.36 -9.64 -0.28 0
136648 52078663 1 ClSN4O4C24H31 ABC4D4E24F31 -127.0 7.86 -8.98 -0.14 1
136649 52078758 1 S2O3N4C23H33 A2B3C4D23E33 -82.38 5.11 0.0 0.0 0
136650 52078799 1 S2N3O3C23H25 A2B3C3D23E25 -44.17 4.09 -8.6 -0.02 0
136651 52078800 1 SN3O4C26H35 AB3C4D26E35 -138.45 5.22 -8.84 0.17 0
136652 52078912 1 S2N4O5C24H26 A2B4C5D24E26 -111.27 8.58 -8.28 -0.58 0
136653 52078913 1 S2N4O5C24H26 A2B4C5D24E26 -110.97 3.29 -8.38 -0.71 0
136654 52078914 1 ClSO2N4C17H17 ABC2D4E17F17 39.63 1.65 -8.95 -1.2 0
136655 52078915 1 ClSO2N4C18H19 ABC2D4E18F19 28.52 2.3 -8.93 -1.02 0
136656 52078916 1 SCl2O2N4H16C17 AB2C2D4E16F17 30.22 0.98 -9.15 -1.43 0
136657 52078917 1 SCl2O2N4H16C17 AB2C2D4E16F17 33.62 2.41 -9.01 -1.39 0
136658 52079320 1 NSO4C21H23 ABC4D21E23 -129.89 7.65 -8.99 -0.57 0
136659 52080236 1 SO3N7H11C17 AB3C7D11E17 135.4 10.74 -9.34 -1.97 0
136660 52080675 1 FSO2N3C20H20 ABC2D3E20F20 -53.17 3.22 -8.62 -0.95 0
136661 52080949 1 FSN3O3H18C22 ABC3D3E18F22 -49.57 5.36 -8.61 -0.99 0
136662 52081493 1 NOS2C19H19 ABC2D19E19 9.03 4.16 -8.41 -0.41 0
136663 52082023 1 FSO5H17C19 ABC5D17E19 -195.53 6.99 -9.46 -0.94 0
136664 52082351 1 SN3O3C23H23 AB3C3D23E23 -30.02 8.26 -9.18 -0.55 0
136665 52082503 1 SN3O3C20H21 AB3C3D20E21 -65.0 4.21 -9.16 -0.8 0
136666 52082760 1 ClN2O3C21H23 AB2C3D21E23 -82.45 3.4 -8.59 -0.18 0
136667 52082761 2 NO2C11H13 AB2C11D13 -107.57 6.02 -8.08 -0.02 0
136668 52083070 1 NSF3O3H20C23 ABC3D3E20F23 -206.9 3.17 -8.7 -0.85 0
136669 52083071 1 N2O3C27H30 A2B3C27D30 -61.29 4.32 -8.52 -0.32 0
136670 52083322 1 ClSO2N5H16C19 ABC2D5E16F19 54.91 6.99 -9.06 -1.33 0
136671 52083359 1 ClOSN5H12C17 ABCD5E12F17 99.93 4.02 -9.33 -1.54 0
136672 52083403 1 SO3N5H19C20 AB3C5D19E20 30.11 9.0 -8.77 -1.13 0
136673 52083495 1 FOSCl2N5H14C17 ABCD2E5F14G17 44.42 8.27 -9.12 -1.38 0
136674 52083496 1 FOSCl2N5H14C17 ABCD2E5F14G17 45.88 9.76 -9.06 -1.3 0
136675 52083497 1 FSO2N5H14C18 ABC2D5E14F18 12.66 14.14 -8.74 -1.38 0
136676 52083710 1 ClFSO2N5H11C17 ABCD2E5F11G17 31.1 9.04 -8.9 -1.54 0
136677 52083711 1 SCl2O3N5H13C18 AB2C3D5E13F18 29.52 3.8 -9.15 -1.78 0
136678 52083793 1 ClSO3N5H20C21 ABC3D5E20F21 18.53 10.37 -8.87 -1.52 0
136679 52084380 1 NOSC10H21 ABCD10E21 -83.44 2.63 -8.64 0.64 0
136680 52084497 1 Cl2S2N3O3C17H17 A2B2C3D3E17F17 -52.35 11.59 -9.32 -1.06 0
136681 52084498 1 Cl2S2N3O3C17H17 A2B2C3D3E17F17 -52.91 7.92 -9.3 -1.1 0
136682 52084719 1 ClS2N3O5H16C18 AB2C3D5E16F18 -105.72 10.01 -9.25 -1.3 0
136683 52084720 1 S2Cl3N3O4H12C17 A2B3C3D4E12F17 -78.22 5.93 -9.11 -1.69 0
136684 52084722 1 Cl2S2N3O3H13C18 A2B2C3D3E13F18 -18.82 11.12 -9.32 -1.65 0
136685 52084828 1 O2S2N5H11C15 A2B2C5D11E15 90.78 4.13 -9.21 -1.57 0
136686 52085191 1 ClON2S2H15C19 ABC2D2E15F19 54.62 4.4 -8.45 -0.84 0
136687 52085192 1 ON2S2H18C20 AB2C2D18E20 53.74 6.46 -8.38 -0.8 0
136688 52085193 1 OCl2N2S2H14C19 AB2C2D2E14F19 45.98 5.54 -8.42 -1.27 0
136689 52085407 1 N2S2O3C22H22 A2B2C3D22E22 -21.16 5.96 -8.29 -0.75 0
136690 52085759 1 N2O2S2C21H22 A2B2C2D21E22 -7.64 5.82 -8.38 -0.82 0
136691 52086089 1 N2S2O3C20H22 A2B2C3D20E22 -47.83 5.67 -8.51 -0.9 0
136692 52086176 1 FN2O4C19H19 AB2C4D19E19 -162.99 4.34 -8.59 -0.52 0
136693 52086177 1 FN2O4C19H19 AB2C4D19E19 -173.54 4.64 -8.67 -0.57 0
136694 52086486 2 NO2C10H11 AB2C10D11 -128.98 4.02 -8.51 -0.36 0
136695 52086531 1 FN2O4C20H21 AB2C4D20E21 -172.84 3.12 -8.51 -0.52 0
136696 52086600 2 NO2C11H13 AB2C11D13 -141.33 6.21 -8.44 -0.37 0
136697 52086601 2 NO2C11H13 AB2C11D13 -140.39 4.56 -8.43 -0.38 0
136698 52086631 1 ClN2O3H19C20 AB2C3D19E20 -75.15 6.69 -8.46 -0.89 0
136699 52087321 1 N2O4C23H28 A2B4C23D28 -152.71 6.6 -8.45 -0.4 0
136700 52087392 1 N3O6C21H23 A3B6C21D23 -133.6 6.24 -8.41 -1.68 0
136701 52087393 1 N3O6C21H23 A3B6C21D23 -136.15 7.54 -8.43 -1.73 0
136702 52087394 1 N2O5C22H26 A2B5C22D26 -167.21 3.79 -8.5 -0.37 0
136703 52087395 1 N2O5C22H26 A2B5C22D26 -165.82 6.67 -8.39 -0.27 0
136704 52087396 1 Cl2N2O4C21H22 A2B2C4D21E22 -145.92 3.06 -8.5 -0.92 0
136705 52087397 1 Cl2N2O4C21H22 A2B2C4D21E22 -145.86 4.13 -8.53 -1.01 0
136706 52087398 2 NO2C11H13 AB2C11D13 -135.79 4.53 -8.42 -0.31 0
136707 52087537 1 FN2O4C23H27 AB2C4D23E27 -187.53 3.2 -8.45 -0.54 0
136708 52087565 1 N2O4C23H28 A2B4C23D28 -135.53 3.68 -8.75 -0.5 0
136709 52087760 1 SN3O4H23C25 AB3C4D23E25 -65.77 3.56 -8.55 -0.73 0
136710 52087914 1 N3O5C27H27 A3B5C27D27 -79.94 2.42 -8.62 -0.6 1
136711 52087983 1 O2N3C25H30 A2B3C25D30 -2.9 2.71 0.0 0.0 0