List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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
4721 11921 1 ClNO2H6C7 ABC2D6E7 5.46 4.53 -10.45 -1.54 0
4722 11922 1 N2O2H4C7 A2B2C4D7 56.71 6.99 -10.96 -1.88 0
4723 11925 1 ClNC10H10 ABC10D10 35.95 7.68 -7.55 0.23 0
4724 11926 1 NH9C10 AB9C10 41.04 2.47 -9.21 -0.6 0
4725 11927 1 NH9C10 AB9C10 40.4 2.33 -9.21 -0.6 0
4726 11928 1 ClNH6C9 ABC6D9 43.22 3.59 -9.5 -1.0 0
4727 11929 1 ON2C8H10 AB2C8D10 28.52 3.42 -9.07 -0.49 0
4728 11930 6 H3C4 A3B4 94.08 0.01 -8.98 -0.34 0
4729 11931 14 CH AB 26.95 1.06 -8.96 0.05 0
4730 11934 4 H3C4 A3B4 62.98 0.02 -8.8 -0.5 0
4731 11935 1 ON2H12C13 AB2C12D13 61.05 3.48 -9.19 -0.46 0
4732 11936 3 H4C5 A4B5 49.33 0.89 -8.26 -0.88 0
4733 11938 1 NH11C14 AB11C14 60.78 2.42 -8.71 -1.12 0
4734 11941 14 CH AB 27.25 0.1 -8.7 0.15 0
4735 11943 1 OH12C13 AB12C13 6.18 1.72 -8.64 0.05 0
4736 11944 1 NH7C11 AB7C11 71.36 4.44 -9.38 -1.05 0
4737 11946 1 N2O2H6C9 A2B2C6D9 47.09 6.72 -10.13 -1.77 0
4738 11950 1 O2C9H10 A2B9C10 -52.7 5.43 -9.28 -0.53 0
4739 11951 2 NC5H5 AB5C5 33.4 2.48 -8.19 -0.16 0
4740 11953 1 NOH5C8 ABC5D8 31.8 4.64 -10.44 -1.42 0
4741 11954 1 NOC8H9 ABC8D9 -18.59 3.96 -9.79 -0.22 0
4742 11955 1 ON2C7H8 AB2C7D8 1.57 2.99 -10.04 -0.48 0
4743 11957 1 ON2C7H8 AB2C7D8 34.99 3.47 -9.1 -0.54 0
4744 11959 1 NOC9H11 ABC9D11 -26.21 3.96 -9.8 -0.23 0
4745 11961 1 O3C10H10 A3B10C10 -105.62 5.09 -10.22 -0.82 0
4746 11963 1 ClN2O2C14H23 AB2C2D14E23 -129.0 9.9 -9.16 -0.63 0
4747 11964 2 NOC7H11 ABC7D11 -84.34 2.75 -8.79 -0.19 0
4748 11965 1 FO2C9H9 AB2C9D9 -111.73 1.67 -10.12 -0.69 0
4749 11966 1 O3C11H14 A3B11C14 -55.03 3.11 -9.95 -0.63 0
4750 11967 1 FO2C10H11 AB2C10D11 -118.88 2.23 -10.13 -0.68 0
4751 11968 1 O3H8C9 A3B8C9 -91.09 7.42 -9.54 -0.96 0
4752 11969 1 ClO3H7C8 AB3C7D8 -105.32 5.62 -9.58 -0.63 0
4753 11970 1 O3C8H8 A3B8C8 -113.83 6.07 -9.63 -0.45 0
4754 11971 1 SN2C8H10 AB2C8D10 31.71 2.51 -8.88 -0.39 0
4755 11972 1 NO2C8H9 AB2C8D9 -71.02 3.74 -8.63 -0.02 0
4756 11974 1 Br2O2N4C17H18 A2B2C4D17E18 9.56 4.16 -9.32 -0.64 0
4757 11975 1 OCl2N2C7H12 AB2C2D7E12 -92.09 5.27 -8.24 -0.07 0
4758 11976 1 ON2C7H10 AB2C7D10 -19.29 1.6 -8.12 0.42 0
4759 11977 1 N2O3C5H10 A2B3C5D10 -88.73 1.95 -9.98 -0.64 0
4760 11979 2 NC4H4 AB4C4 40.88 3.76 -8.9 -0.13 0
4761 11981 1 NO2C7H7 AB2C7D7 -10.75 3.09 -9.05 -1.14 0
4762 11982 1 O3C8H10 A3B8C10 -99.59 1.82 -9.98 -0.58 0
4763 11984 2 NC4H4 AB4C4 39.79 3.71 -8.93 -0.09 0
4764 11985 1 ON2H6C7 AB2C6D7 -11.82 3.35 -8.86 -0.33 0
4765 11988 1 SN3C7H7 AB3C7D7 69.36 1.71 -8.83 -0.7 0
4766 11989 1 NS2H7C8 AB2C7D8 52.05 0.65 -8.73 -0.76 0
4767 11990 2 ClNC3H5 ABC3D5 -45.05 1.93 -8.94 -0.42 0
4768 11991 1 OC7H16 AB7C16 -84.4 1.93 -10.12 3.04 0
4769 11993 1 ClIH4C6 ABC4D6 34.14 2.3 -9.53 -1.11 0
4770 11994 2 IH2C3 AB2C3 58.29 2.16 -9.37 -1.29 0