List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
393454 135020626 1 O2H14C27 A2B14C27 52.47 7.49 -8.79 -1.46 0
393455 135020628 1 NS2C8H15 AB2C8D15 36.06 4.19 -8.74 -0.47 0
393456 135020629 1 O2C13H18 A2B13C18 -84.83 1.33 -9.92 -0.36 0
393457 135020632 1 SO3C19H26 AB3C19D26 -151.72 2.82 -8.6 -0.76 0
393458 135020634 1 NSO6C16H27 ABC6D16E27 -268.52 3.71 -8.36 0.26 0
393459 135020635 1 SiO2C26H34 AB2C26D34 -76.66 3.31 -9.26 0.36 0
393460 135020636 1 NOSiC19H25 ABCD19E25 -24.25 2.91 -9.3 -0.26 0
393461 135020637 1 OC12H20 AB12C20 -54.6 3.08 -9.43 0.37 0
393462 135020639 4 NH7C9 AB7C9 133.13 3.1 -8.36 -0.24 0
393463 135020640 4 NH7C9 AB7C9 135.43 1.96 -8.38 -0.09 0
393464 135020642 1 Si2O5C24H50 A2B5C24D50 -361.78 3.6 -8.65 0.7 0
393465 135020643 1 O5C19H26 A5B19C26 -187.1 3.44 -9.53 0.18 0
393466 135020644 2 SiO3C11H22 AB3C11D22 -378.8 4.63 -8.67 -0.09 0
393467 135020645 1 ON2H12C15 AB2C12D15 54.25 3.73 -8.88 -1.42 0
393468 135020646 1 ClNO3H14C21 ABC3D14E21 -22.99 5.59 -9.41 -1.29 0
393471 135020701 1 N3O3C20H22 A3B3C20D22 -18.08 1.29 0.0 0.0 0
393472 135020703 1 NO3C20H21 AB3C20D21 -73.06 3.31 -9.46 -0.17 0
393473 135020704 3 NOC5H9 ABC5D9 -119.37 3.84 -9.43 -0.86 1
393474 135020705 1 N3O3C15H28 A3B3C15D28 -98.94 6.14 0.0 0.0 0
393475 135020729 1 NO5C22H23 AB5C22D23 -155.42 2.29 -8.01 0.05 0
393476 135020731 1 NO4C21H21 AB4C21D21 -116.72 1.75 -8.43 0.01 0
393477 135020732 1 NO4C19H25 AB4C19D25 -163.1 3.81 -8.85 0.16 0
393478 135020733 1 NO4C14H15 AB4C14D15 -129.15 1.44 -9.09 -0.92 0
393479 135020734 1 BSN2O2C17H21 ABC2D2E17F21 -110.08 3.89 -8.74 -0.6 0
393480 135020741 1 SSiO4C25H34 ABC4D25E34 -128.0 10.5 -8.83 -0.83 0
393481 135020742 1 PO4C9H21 AB4C9D21 -282.08 3.24 -10.76 0.88 0
393482 135020743 1 PN4O5C38H47 AB4C5D38E47 -115.31 1.15 -7.92 -1.32 0
393483 135020744 1 O5C18H26 A5B18C26 -202.69 2.66 -8.7 -0.32 0
393484 135020745 1 SiO4C16H32 AB4C16D32 -259.28 4.32 -9.26 -0.31 0
393485 135020746 1 SiO4C19H34 AB4C19D34 -239.62 1.64 -9.32 -0.4 0
393486 135020747 1 BrN2H15C20 AB2C15D20 101.77 5.52 -8.84 -0.8 0
393487 135020748 1 N3C25H35 A3B25C35 36.33 1.3 -8.29 0.4 0
393488 135020750 1 N2O3C21H22 A2B3C21D22 -71.68 4.81 -9.5 -0.9 0
393490 135020753 1 ClPN5O7C16H17 ABC5D7E16F17 -271.49 10.62 -9.68 -0.91 1
393491 135020756 1 AgPO4H29C44 ABC4D29E44 -130.14 16.02 0.0 0.0 0
393492 135020757 1 NO3C15H27 AB3C15D27 -179.37 3.72 -9.52 0.57 0
393493 135020758 2 O3C7H8 A3B7C8 -189.14 2.14 -9.89 -0.43 0
393494 135020761 1 ON3C19H35 AB3C19D35 -25.54 4.34 -9.83 0.13 0
393495 135020763 1 ON3C20H37 AB3C20D37 -32.07 4.05 -9.75 0.24 0
393496 135020764 2 IH8C21 AB8C21 178.22 0.11 -8.34 -1.67 0
393497 135020765 2 H23C55 A23B55 536.4 1.15 -7.63 -1.79 0
393498 135020766 1 OSSiC20H34 ABCD20E34 -81.5 3.6 -7.97 0.29 0
393499 135020768 1 SiO2C18H30 AB2C18D30 -124.22 3.73 -9.54 0.2 0
393500 135020770 1 NOH15C17 ABC15D17 54.44 4.5 -8.85 -0.05 0
393501 135020855 1 NO2H19C23 AB2C19D23 68.17 6.8 -9.21 -1.24 0
393502 135020857 1 NO5H9C13 AB5C9D13 -45.71 4.24 -9.75 -1.97 0
393503 135020860 1 ISN2H13C14 ABC2D13E14 70.45 4.01 -8.63 -1.09 0
393505 135020867 1 NO4C22H23 AB4C22D23 -117.96 3.96 -9.17 0.05 0
393506 135020870 2 NO3C6H7 AB3C6D7 -191.18 1.88 -10.28 -0.85 0
393507 135020872 2 OH10C12 AB10C12 -6.16 2.96 -8.58 -0.51 0
393508 135020873 2 OH8C11 AB8C11 6.22 1.31 -8.42 -0.8 0
393509 135020874 1 ON3C23H29 AB3C23D29 -9.71 3.48 -8.7 -0.67 1
393510 135020875 1 NC16H22 AB16C22 55.48 3.36 0.0 0.0 0
393511 135020876 2 N2O2C11H12 A2B2C11D12 -73.99 6.69 -8.96 -0.52 0
393512 135020877 1 NO5H21C22 AB5C21D22 -126.19 2.51 -8.81 -0.36 0
393513 135020878 2 N2O2C11H12 A2B2C11D12 -73.99 6.69 -8.97 -0.52 0
393514 135020879 1 O3N6C22H22 A3B6C22D22 43.99 0.91 -8.84 -0.81 1
393515 135020880 1 O3N6C22H23 A3B6C22D23 45.32 3.42 0.0 0.0 0
393516 135020882 1 N5O5C28H35 A5B5C28D35 -134.96 6.05 -9.16 -0.72 0
393517 135020883 1 NPSO6C23H34 ABCD6E23F34 -258.19 7.6 -9.12 -0.1 0
393518 135020884 1 NSO2C19H23 ABC2D19E23 -45.02 7.56 -8.75 -0.26 0
393519 135020885 1 ON4C10H12 AB4C10D12 52.86 5.96 -9.91 -0.43 0
393520 135020886 1 BrN2S2O4H13C15 AB2C2D4E13F15 -77.76 3.46 -8.53 -1.63 0
393521 135020887 1 BrN2S2O4H15C16 AB2C2D4E15F16 -84.12 3.33 -8.66 -1.41 0
393522 135020888 1 O8C19H24 A8B19C24 -303.01 2.55 -9.02 -0.76 0
393523 135020889 1 NSO3C17H25 ABC3D17E25 -110.08 4.98 -9.33 -0.29 0
393524 135020890 1 OC15H18 AB15C18 11.25 2.13 -9.37 0.37 0
393525 135020898 1 SO2N3C33H33 AB2C3D33E33 24.94 3.65 -8.77 -0.98 0
393526 135020899 1 O2N3C27H27 A2B3C27D27 15.69 1.8 -9.25 -1.24 1
393527 135020900 1 O2N3C27H28 A2B3C27D28 3.21 2.39 0.0 0.0 0
393528 135020901 1 NOC17H23 ABC17D23 -3.89 4.02 -9.01 0.02 0
393529 135020902 1 BrO2N4C29H31 AB2C4D29E31 7.55 3.98 -9.06 -0.7 0
393530 135020903 1 ON4H16C21 AB4C16D21 130.06 3.81 -8.74 -0.89 0
393531 135020904 1 ON2H14C21 AB2C14D21 54.32 1.9 -8.36 -0.87 0
393532 135020905 1 ON4H14C17 AB4C14D17 98.15 4.94 -8.48 -0.86 0
393533 135020906 1 ON2H12C17 AB2C12D17 24.72 2.16 -8.31 -0.8 0
393534 135020908 1 ON2H14C18 AB2C14D18 13.79 2.07 -8.28 -0.78 0
393535 135020917 1 NS2O9C22H33 AB2C9D22E33 -386.91 4.94 -8.2 -0.43 1
393536 135020922 1 O2N4H13C14 A2B4C13D14 29.12 6.17 0.0 0.0 0
393537 135020944 1 NSO4C16H23 ABC4D16E23 -119.68 6.75 -9.44 -0.31 0
393538 135020945 1 O4C15H18 A4B15C18 -141.78 3.57 -8.74 -0.13 0
393539 135020946 1 NPSO6C22H32 ABCD6E22F32 -244.46 9.82 -9.57 -0.56 0
393540 135020975 1 ON3C25H33 AB3C25D33 27.1 1.85 -8.53 -0.21 2
393541 135020996 2 NC15H22 AB15C22 46.22 20.27 -5.5 -0.65 0
393542 135021004 4 NC8H10 AB8C10 104.65 4.92 -8.26 -1.27 0
393543 135021006 4 NC8H10 AB8C10 90.63 3.54 -8.23 -1.19 0
393544 135021011 1 NO3C7H11 AB3C7D11 -131.56 2.75 -10.3 -0.25 0
393545 135021012 1 OC9H16 AB9C16 -54.09 3.4 -10.05 0.74 0
393546 135021013 1 SiN2C28H32 AB2C28D32 76.32 3.8 -8.64 -0.91 0
393547 135021015 1 N3O3C17H23 A3B3C17D23 -76.77 3.17 -9.38 -0.84 1
393548 135021016 1 N3O3C17H24 A3B3C17D24 -62.25 2.68 0.0 0.0 0
393549 135021017 1 NO3C17H23 AB3C17D23 -136.68 3.47 -9.56 0.0 0
393550 135021018 1 S2O5C18H24 A2B5C18D24 -194.93 6.29 -9.03 -0.77 0
393551 135021019 1 S2O5C21H30 A2B5C21D30 -210.53 6.41 -9.0 -0.71 1
393552 135021021 1 PC38H46 AB38C46 82.89 7.32 0.0 0.0 0
393553 135021025 1 ON2C18H26 AB2C18D26 -3.86 2.31 -8.88 -0.24 0
393554 135021030 1 ClO4H15C21 AB4C15D21 -95.43 4.94 -9.89 -1.03 0
393555 135021031 1 SN2O4H22C24 AB2C4D22E24 -95.91 8.83 -9.79 -0.55 0
393556 135021033 1 N3O3H17C25 A3B3C17D25 51.26 8.82 -9.31 -1.61 0
393557 135021034 1 N4O5H18C30 A4B5C18D30 80.9 4.34 -9.99 -1.75 0