List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
317686 126645018 1 O2N5C20H23 A2B5C20D23 0.85 5.44 -8.43 -0.43 0
317687 126645022 1 BrNF3H13C17 ABC3D13E17 -112.25 6.18 -8.74 -0.83 0
317689 126645119 1 N2F3O4H21C22 A2B3C4D21E22 -265.46 1.44 -8.86 -1.04 0
317690 126645134 1 N2O3C21H22 A2B3C21D22 -52.71 3.09 -7.99 -0.26 0
317692 126645157 1 NF3O3H22C24 AB3C3D22E24 -210.41 6.96 -8.78 -0.88 0
317696 126645200 1 N2O3C25H32 A2B3C25D32 -98.38 1.43 -8.06 0.21 0
317697 126645201 1 F3O3N5H16C18 A3B3C5D16E18 -163.76 2.73 -8.82 -1.1 0
317698 126645202 1 N2O5C20H20 A2B5C20D20 -110.12 3.65 -8.92 -0.8 0
317700 126645205 1 NO5C16H20 AB5C16D20 -104.2 6.94 0.0 0.0 0
317702 126645207 1 ClN2O5H15C17 AB2C5D15E17 -121.1 3.99 -9.0 -1.11 0
317703 126645208 2 NO2C9H10 AB2C9D10 -82.5 6.6 -8.76 -0.5 0
317704 126645209 1 N2O3C16H22 A2B3C16D22 -83.51 5.02 -8.65 -0.43 0
317705 126645210 1 NO2C27H35 AB2C27D35 -78.31 1.48 -8.45 0.43 0
317706 126645211 1 O2F3N3C25H28 A2B3C3D25E28 -178.55 7.03 -8.48 -0.44 0
317707 126645212 1 N3O4C17H17 A3B4C17D17 -72.29 4.57 -9.02 -0.94 0
317708 126645221 1 N2O2F3C24H25 A2B2C3D24E25 -191.56 6.77 -8.55 -0.51 0
317709 126645243 1 ClN2O2C22H23 AB2C2D22E23 -39.59 3.73 -8.15 -0.13 0
317711 126645279 1 OF3N5C28H34 AB3C5D28E34 -138.39 6.83 -8.58 -0.64 0
317712 126645327 1 NaN2O2C22H25 AB2C2D22E25 -85.68 9.66 -7.67 0.28 0
317713 126645328 1 SN2O6C15H20 AB2C6D15E20 -202.02 1.34 -8.88 -0.78 0
317714 126645344 1 NF3O4C20H20 AB3C4D20E20 -268.61 8.3 -9.1 -0.63 0
317715 126645346 1 N2O3C26H32 A2B3C26D32 -82.25 2.04 -8.16 0.09 0
317717 126645356 1 N2F3O4H21C22 A2B3C4D21E22 -269.12 3.73 -8.86 -0.9 0
317718 126645367 1 F3O4N5H10C16 A3B4C5D10E16 -130.16 4.76 -9.39 -1.88 0
317720 126645372 3 NO2H5C6 AB2C5D6 -119.22 2.94 -9.19 -1.1 0
317723 126645414 2 NO2C9H9 AB2C9D9 -86.27 9.13 -8.9 -0.53 0
317726 126645438 1 N2O3C22H26 A2B3C22D26 -83.11 1.33 -8.06 0.22 0
317730 126645560 1 F3N3O3H6C10 A3B3C3D6E10 -196.79 6.68 -10.15 -1.75 0
317731 126645569 1 NO6H15C18 AB6C15D18 -192.06 6.17 -9.33 -1.14 0
317732 126645580 1 N3O5C22H25 A3B5C22D25 -127.78 4.35 -8.75 -0.73 0
317733 126645581 1 N2O5C18H18 A2B5C18D18 -119.22 4.08 -9.0 -0.9 0
317734 126645582 1 N3O5C22H23 A3B5C22D23 -125.15 2.67 -9.17 -1.04 0
317736 126645592 1 O2F3N3H6C10 A2B3C3D6E10 -143.5 3.77 -9.87 -1.47 0
317737 126645593 1 F3O3N7H10C17 A3B3C7D10E17 -97.22 8.11 -9.41 -1.64 0
317738 126645594 1 ON2C6H10 AB2C6D10 -29.91 3.73 -9.72 0.99 0
317740 126645598 1 NO5C12H21 AB5C12D21 -272.06 4.61 -10.12 0.51 0
317741 126645608 1 NaN2O3C24H29 AB2C3D24E29 -75.97 35.71 -7.01 -1.16 0
317742 126645611 2 ClNO2H8C9 ABC2D8E9 -104.76 4.05 -9.16 -0.88 0
317743 126645613 1 NO4C25H29 AB4C25D29 -139.29 1.39 -8.36 -0.32 0
317744 126645614 1 N2O5C18H18 A2B5C18D18 -120.41 1.47 -8.99 -0.84 0
317745 126645633 1 N2F3O3H15C17 A2B3C3D15E17 -194.2 3.98 -9.02 -0.63 0
317747 126645641 1 SF3O3N8H27C29 AB3C3D8E27F29 -146.06 1.67 -8.86 -1.12 0
317748 126645642 1 SF3O3N7H28C30 AB3C3D7E28F30 -157.07 3.18 -8.77 -1.01 0
317751 126645659 1 N2F4O4H12C17 A2B4C4D12E17 -277.93 3.01 -9.37 -1.2 0
317752 126645667 1 ClFN2O4H16C18 ABC2D4E16F18 -144.67 3.39 -9.14 -0.84 0
317753 126645668 1 O2F5N6H21C22 A2B5C6D21E22 -237.52 5.91 -9.21 -1.34 0
317755 126645676 2 NSO3C9H10 ABC3D9E10 -163.2 3.7 -9.36 -1.35 0
317756 126645681 1 N4O4H14C17 A4B4C14D17 -40.39 5.06 -9.01 -0.94 0
317757 126645685 1 SN2O5C17H18 AB2C5D17E18 -118.34 3.43 -8.72 -0.71 0
317758 126645687 2 NO2H5C6 AB2C5D6 -38.59 2.51 -9.23 -1.13 0
317759 126645689 1 N3O5H15C19 A3B5C15D19 -73.21 5.02 -9.19 -1.04 0
317760 126645690 2 NO2H10C11 AB2C10D11 -73.19 2.02 -9.01 -0.79 0
317762 126645698 1 NO5H17C18 AB5C17D18 -150.55 6.23 -8.96 -0.9 0
317763 126645699 1 N3O5H19C20 A3B5C19D20 -120.23 4.59 -8.71 -0.91 0
317765 126645708 1 ClFN2O4H12C16 ABC2D4E12F16 -126.67 3.02 -9.29 -1.04 0
317766 126645711 1 ClSF3O4N7H25C29 ABC3D4E7F25G29 -192.58 5.1 -8.27 -1.28 0
317768 126645713 1 ClNSO4F7H25C27 ABCD4E7F25G27 -469.88 7.95 -9.59 -1.3 0
317769 126645714 1 F3O3N7H12C18 A3B3C7D12E18 -92.1 8.94 -9.3 -1.51 0
317770 126645717 1 F3O3N4H13C17 A3B3C4D13E17 -175.35 5.54 -9.06 -1.18 0
317771 126645718 1 ClFN2O4H12C16 ABC2D4E12F16 -127.02 3.25 -9.34 -1.04 0
317772 126645724 1 NSO4F6C29H31 ABC4D6E29F31 -425.41 6.86 -9.22 -0.92 0
317773 126645725 1 SF3O5N7H28C30 AB3C5D7E28F30 -220.58 2.06 -8.47 -1.05 0
317775 126645727 1 F3O3N5H14C17 A3B3C5D14E17 -162.46 3.24 -9.01 -1.15 0
317776 126645731 1 ClN3O4H26C27 AB3C4D26E27 -60.53 5.85 -8.96 -0.93 0
317779 126645743 1 ClN3O5H12C17 AB3C5D12E17 -87.52 2.45 -9.3 -1.34 0
317780 126645745 1 N2O5C18H18 A2B5C18D18 -120.42 1.48 -9.0 -0.83 0
317781 126645746 2 NO2C10H11 AB2C10D11 -96.57 1.41 -9.05 -0.91 0
317782 126645747 1 N3O4H15C18 A3B4C15D18 -56.13 2.37 -8.72 -0.78 0
317783 126645748 2 NO2C10H11 AB2C10D11 -107.59 2.55 -8.94 -0.76 0
317784 126645749 1 NO5C19H19 AB5C19D19 -158.69 2.91 -8.93 -0.86 0
317787 126645764 1 O3F4N4H12C17 A3B4C4D12E17 -228.32 10.74 -9.13 -1.56 0
317788 126645765 1 N2O5C21H24 A2B5C21D24 -137.37 4.44 -8.88 -0.79 0
317789 126645766 1 N4O4H16C19 A4B4C16D19 -32.94 4.36 -9.32 -1.06 0
317790 126645767 1 N3O5H19C20 A3B5C19D20 -105.77 5.43 -9.06 -0.89 0
317792 126645769 1 FSO2N5C17H18 ABC2D5E17F18 -40.32 6.97 -8.53 -0.83 0