List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
4646 11801 1 ClNSO2C12H12 ABCD2E12F12 -42.95 8.23 -9.15 -1.41 0
4647 11803 2 NO2H3C5 AB2C3D5 35.2 0.09 -10.33 -2.31 0
4648 11804 1 O3N4C6H6 A3B4C6D6 -101.43 3.98 -9.2 -0.89 0
4649 11805 3 NOH7C8 ABC7D8 -55.23 0.71 -9.69 -0.88 0
4650 11807 1 NOC4H11 ABC4D11 -66.57 3.57 -9.69 2.85 0
4651 11809 1 BrO3N7C24H30 AB3C7D24E30 7.2 2.83 -8.5 -1.11 0
4652 11810 1 Cl5H5C8 A5B5C8 -22.13 1.88 -9.64 -1.15 0
4653 11811 2 NO2C5H6 AB2C5D6 -145.45 4.74 -9.16 -1.17 0
4654 11812 1 O5H6C8 A5B6C8 -190.92 5.98 -10.5 -1.76 0
4655 11816 3 OH4C5 AB4C5 -62.63 4.64 -9.92 -0.89 0
4656 11817 1 N3H5C7O7 A3B5C7D7 -18.27 3.64 -11.17 -2.44 0
4657 11819 1 ClOH7C10 ABC7D10 -13.9 0.97 -8.77 -0.67 0
4658 11820 1 NOH9C10 ABC9D10 -7.93 4.0 -8.86 -0.8 0
4659 11821 2 INO3C17H23 ABC3D17E23 -152.89 25.94 -6.9 -0.85 0
4660 11823 2 NOH4C5 ABC4D5 28.36 6.01 -8.94 -1.27 0
4661 11827 1 ClOH9C12 ABC9D12 -5.31 1.99 -8.97 -0.45 0
4662 11828 1 NOH9C10 ABC9D10 27.72 1.1 -8.92 -0.6 0
4663 11829 1 N2O2H6C9 A2B2C6D9 47.75 3.04 -10.18 -1.83 0
4664 11830 1 N2O2H6C9 A2B2C6D9 50.67 6.89 -10.11 -1.5 0
4665 11832 1 N3H17C18 A3B17C18 111.7 3.71 -8.13 -0.98 0
4666 11833 2 OH4C5 AB4C5 -50.8 5.92 -9.48 -1.03 0
4667 11834 1 NO3C21H23 AB3C21D23 -64.51 7.79 -9.09 -0.83 0
4668 11839 1 OBr3H5C7 AB3C5D7 -2.93 1.94 -9.81 -0.92 0
4669 11844 1 NCl2H5C6 AB2C5D6 5.08 3.32 -8.83 -0.29 0
4670 11845 3 HIC2 ABC2 77.6 2.05 -9.01 -1.62 0
4671 11846 1 NCl2H5C6 AB2C5D6 3.41 1.11 -8.75 -0.34 0
4672 11848 2 O2C3H5 A2B3C5 -191.48 6.14 -10.95 -0.16 0
4673 11852 1 HOBr5C6 ABC5D6 4.3 1.72 -9.7 -1.46 0
4674 11853 6 CI AB 141.35 0.0 -8.43 -2.13 0
4675 11854 1 HBr5C6 AB5C6 46.62 0.8 -10.01 -1.4 0
4676 11855 1 HCl5C6 AB5C6 -8.31 0.83 -9.73 -1.26 0
4677 11856 1 HI5C6 AB5C6 117.76 0.66 -8.78 -1.98 0
4678 11858 1 ClO3C6H9 AB3C6D9 -146.41 2.79 -10.61 -0.73 0
4679 11859 1 OCl3H3C6 AB3C3D6 -42.78 2.7 -9.41 -0.87 0
4680 11860 2 ClNC3H3 ABC3D3 2.79 3.24 -8.2 -0.41 0
4681 11861 1 OBr2H6C7 AB2C6D7 -24.79 1.46 -9.23 -0.56 0
4682 11864 1 NO3C4H9 AB3C4D9 -71.36 3.19 -11.03 -0.62 0
4683 11865 1 NH3O3C4 AB3C3D4 -4.33 5.08 -10.64 -1.49 0
4684 11866 1 NSO2H3C4 ABC2D3E4 24.56 5.24 -9.9 -1.68 0
4685 11867 1 SO4C6H6 AB4C6D6 -152.66 3.66 -9.79 -0.89 0
4686 11868 1 SO3C8H10 AB3C8D10 -120.53 4.89 -9.68 -0.65 0
4687 11871 1 NCl2H3O3C6 AB2C3D3E6 -36.0 4.4 -9.9 -1.57 0
4688 11872 1 N2O5H6C7 A2B5C6D7 -36.71 5.31 -10.28 -2.15 0
4689 11873 1 N2H4C7O7 A2B4C7D7 -112.59 3.74 -11.49 -2.7 0
4690 11874 1 O5H6C7 A5B6C7 -189.43 6.92 -9.6 -1.1 0
4691 11877 2 NOC4H5 ABC4D5 20.77 5.68 -9.19 -0.8 0
4692 11878 1 N3H5O6C7 A3B5C6D7 15.83 5.39 -11.58 -2.69 0
4693 11879 1 N2H4O6C7 A2B4C6D7 -56.72 4.47 -11.74 -2.87 0
4694 11880 1 N2H4O6C7 A2B4C6D7 -57.1 2.92 -11.8 -2.77 0
4695 11881 1 O5H6C8 A5B6C8 -188.85 6.57 -10.15 -1.54 0
4696 11882 1 NH5O5C7 AB5C5D7 -104.18 6.46 -10.58 -1.94 0
4697 11883 1 N2O4H6C7 A2B4C6D7 14.05 8.44 -10.9 -1.9 0
4698 11884 3 H4C5 A4B5 50.58 0.83 -8.25 -0.88 0
4699 11885 1 NH11C14 AB11C14 57.98 1.94 -8.0 -0.89 0
4700 11887 1 N2O5C8H8 A2B5C8D8 -31.1 8.02 -10.48 -1.72 0
4701 11888 2 NOH3C4 ABC3D4 45.4 5.12 -10.69 -1.64 0
4702 11889 1 NO3C8H9 AB3C8D9 -26.92 6.49 -9.62 -1.07 0
4703 11890 1 NO4H7C8 AB4C7D8 -66.38 3.27 -10.08 -1.36 0
4704 11891 1 Br2O2H4C7 A2B2C4D7 -51.85 4.87 -10.2 -1.36 0
4705 11893 1 NO3C10H15 AB3C10D15 -147.92 1.94 -10.03 -0.53 0
4706 11894 1 BrO2H7C8 AB2C7D8 -55.62 3.18 -9.91 -0.82 0
4707 11895 1 ClO2H7C8 AB2C7D8 -68.3 2.14 -9.86 -0.81 0
4708 11896 1 Br2O2H4C7 A2B2C4D7 -52.06 4.17 -10.42 -1.4 0
4709 11897 1 O2C9H10 A2B9C10 -80.13 5.87 -9.85 -0.38 0
4710 11898 1 N2O2C7H8 A2B2C7D8 1.13 7.91 -9.26 -0.81 0
4711 11901 2 NH2O2C4 AB2C2D4 1.34 6.02 -9.71 -2.54 0
4712 11903 3 C3H4 A3B4 1.81 1.01 -9.04 0.55 0
4713 11904 1 C9H10 A9B10 28.93 0.7 -9.08 0.2 0
4714 11906 1 Cl2H6C7 A2B6C7 -0.09 1.96 -9.7 -0.4 0
4715 11910 1 NH9C10 AB9C10 41.84 1.38 -9.03 -0.57 0
4716 11911 1 N2H8C9 A2B8C9 48.77 3.82 -8.5 -0.56 0
4717 11912 1 NO3C20H21 AB3C20D21 -57.77 5.14 -8.9 -0.93 0
4718 11913 1 NH11C14 AB11C14 62.39 3.17 -8.64 -1.05 0
4719 11915 1 O3H6C8 A3B6C8 -83.14 4.0 -10.39 -1.63 0
4720 11920 1 O3C8H8 A3B8C8 -106.86 5.82 -10.35 -0.97 0