List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
373892 131321078 1 ClNSO2C11H12 ABCD2E11F12 -71.39 4.84 -8.76 -0.43 0
373893 131321082 1 ClNSO2C11H12 ABCD2E11F12 -73.02 4.08 -8.53 -0.21 0
373894 131321091 1 ClFSN3H9C10 ABCD3E9F10 13.45 4.66 -9.43 -1.06 0
373895 131321092 1 ClNO2S2H4C9 ABC2D2E4F9 -8.73 3.53 -9.77 -2.21 0
373896 131321093 1 ClFSN3H9C10 ABCD3E9F10 12.25 2.29 -9.49 -0.86 0
373897 131321094 1 ClNSO3H8C10 ABCD3E8F10 -73.8 2.71 -8.9 -0.57 0
373898 131321098 1 NOSH9C12 ABCD9E12 32.08 4.05 -9.25 -1.49 0
373899 131321103 1 FSO3H7C10 ABC3D7E10 -140.54 5.23 -8.93 -1.2 0
373900 131321109 1 FSO3H7C10 ABC3D7E10 -139.93 7.23 -9.35 -1.01 0
373901 131321120 1 FSO3H7C10 ABC3D7E10 -139.86 4.62 -9.27 -1.1 0
373902 131321121 1 FSO3H7C10 ABC3D7E10 -136.7 4.38 -8.96 -1.21 0
373903 131321133 1 FSO3H7C10 ABC3D7E10 -140.38 2.5 -8.62 -0.99 0
373904 131321146 2 OSC6H6 ABC6D6 -62.68 5.84 -8.8 -0.88 0
373905 131321176 1 SN2O3H4C9 AB2C3D4E9 26.86 2.8 -9.39 -2.3 0
373906 131321178 1 SN2O3H4C9 AB2C3D4E9 27.09 2.55 -9.42 -2.36 0
373907 131321191 1 FSO2H11C12 ABC2D11E12 -107.99 4.66 -8.85 -1.03 0
373908 131321217 1 FNSC11H14 ABCD11E14 -43.45 2.54 -8.65 -0.21 0
373909 131321226 1 NSO2C10H13 ABC2D10E13 -66.56 2.32 -8.96 -0.19 0
373910 131321229 1 NO4C11H13 AB4C11D13 -149.06 0.73 -9.03 -0.76 0
373911 131321237 2 NOC6H7 ABC6D7 -47.76 5.75 -9.27 -0.99 0
373912 131321242 1 BrSO2C12H13 ABC2D12E13 -47.06 4.26 -8.35 -0.85 0
373913 131321250 1 BrSO2C12H13 ABC2D12E13 -42.5 1.64 -8.14 -0.95 0
373914 131321261 1 N2O2F3C9H9 A2B2C3D9E9 -192.95 8.0 -10.89 -0.56 0
373915 131321269 1 O2S2N3H5C9 A2B2C3D5E9 33.44 11.03 -9.12 -2.06 0
373916 131321272 1 BrNOH10C11 ABCD10E11 22.5 6.27 -9.18 -1.42 0
373917 131321273 1 BrNOF2C11H14 ABCD2E11F14 -128.9 0.73 -9.52 -0.83 0
373918 131321274 1 BrN2C13H17 AB2C13D17 17.78 4.54 -8.75 -0.42 0
373919 131321289 1 BrClN2O2F3H3C7 ABC2D2E3F3G7 -210.63 1.5 -10.27 -1.76 0
373920 131321302 1 ClN2C13H13 AB2C13D13 30.37 4.22 -9.06 -0.17 0
373921 131321303 1 ClN2C13H13 AB2C13D13 28.6 4.43 -9.03 -0.11 0
373922 131321307 2 NC5H9 AB5C9 -3.69 3.46 -8.14 1.47 0
373923 131321329 1 SN2O3C10H10 AB2C3D10E10 -50.44 4.15 -8.78 -0.44 0
373924 131321343 1 BrClOSH10C11 ABCDE10F11 -16.63 1.63 -8.75 -1.16 0
373925 131321358 1 N5C7H11 A5B7C11 76.12 1.73 -9.55 0.29 0
373926 131321359 1 N5C7H11 A5B7C11 71.91 2.79 -9.96 0.23 0
373927 131321366 1 BrClSO2H6C10 ABCD2E6F10 -50.3 5.01 -9.32 -1.61 0
373928 131321370 1 BrClSO2H6C10 ABCD2E6F10 -52.93 4.91 -9.46 -1.55 0
373929 131321407 1 NOS2H9C10 ABC2D9E10 23.65 4.03 -9.06 -1.52 0
373930 131321419 1 BrOSF3H6C10 ABCD3E6F10 -157.28 0.84 -9.19 -1.16 0
373931 131321420 1 BrOSF3H6C10 ABCD3E6F10 -154.54 1.37 -8.89 -1.12 0
373932 131321422 1 BrOSF3H6C10 ABCD3E6F10 -154.93 2.49 -9.2 -1.09 0
373933 131321444 1 BrF2O3C10H11 AB2C3D10E11 -203.46 3.4 -8.83 -0.75 0
373934 131321452 1 ClF2O3C10H11 AB2C3D10E11 -222.11 1.39 -9.29 -0.25 0
373935 131321457 1 ClF2O3C10H11 AB2C3D10E11 -210.94 4.45 -8.96 -0.41 0
373936 131321506 1 BrSO3H7C10 ABC3D7E10 -91.53 4.84 -9.21 -1.12 0
373937 131321508 1 BrSO3H7C10 ABC3D7E10 -92.13 4.55 -9.21 -1.04 0
373938 131321520 1 BrSO3H7C10 ABC3D7E10 -85.88 5.04 -9.12 -1.23 0
373939 131321532 1 NSO2H11C12 ABC2D11E12 -46.77 2.31 -8.25 -0.97 0
373940 131321539 1 ClFNSO2H5C10 ABCDE2F5G10 -66.81 0.95 -10.06 -1.89 0
373941 131321557 1 BrClO2C11H12 ABC2D11E12 -76.79 5.77 -9.36 -0.64 0
373942 131321561 1 OSCl2N3H5C8 ABC2D3E5F8 20.71 1.25 -9.76 -2.08 0
373943 131321568 1 BrOF2N3H4C5 ABC2D3E4F5 -91.09 5.55 -10.29 -2.09 0
373944 131321575 1 NO2C12H13 AB2C12D13 -29.88 7.28 -8.33 -0.42 0
373945 131321598 1 ClINSH2O2F3C6 ABCDE2F2G3H6 -180.94 5.35 -10.63 -2.33 0
373946 131321603 1 ISN2O2F3H4C6 ABC2D2E3F4G6 -173.29 5.94 -10.37 -1.88 0
373947 131321618 1 BrClIN2H5C8 ABCD2E5F8 68.03 2.31 -9.43 -1.5 0
373948 131321621 1 BrClFN2H3C5 ABCD2E3F5 -22.87 4.64 -9.47 -0.89 0
373949 131321626 1 BrSO3H9C11 ABC3D9E11 -72.55 6.39 -8.57 -1.26 0
373950 131321635 1 BrSO3H9C11 ABC3D9E11 -86.56 4.65 -8.87 -1.04 0
373951 131321652 1 BrSO3H9C11 ABC3D9E11 -89.09 6.11 -9.13 -0.94 0
373952 131321658 1 BrSO3H9C11 ABC3D9E11 -76.53 4.1 -8.74 -1.21 0
373953 131321672 1 BrSO3H9C11 ABC3D9E11 -83.57 2.13 -8.77 -1.12 0
373954 131321676 1 BrSO3H9C11 ABC3D9E11 -81.89 6.45 -8.97 -1.18 0
373955 131321687 1 ClSN2O2C9H9 ABC2D2E9F9 -35.51 4.66 -10.22 -1.79 0
373956 131321692 1 ClSN2O2C9H9 ABC2D2E9F9 -34.73 8.35 -10.03 -1.51 0
373957 131321707 1 ClOSF2H5C10 ABCD2E5F10 -94.85 4.68 -9.28 -1.63 0
373958 131321720 1 ClNO2F3H7C9 ABC2D3E7F9 -162.34 5.83 -10.68 -1.85 0
373959 131321724 1 NOC13H15 ABC13D15 -13.54 5.57 -9.93 -0.82 0
373960 131321726 1 NOC13H15 ABC13D15 -13.29 5.19 -9.86 -0.8 0
373961 131321727 1 NOC13H15 ABC13D15 -12.9 3.13 -9.93 -1.14 0
373962 131321729 1 NOC13H15 ABC13D15 -13.64 3.75 -9.78 -0.84 0
373963 131321741 1 NOBr2H9C11 ABC2D9E11 13.68 5.08 -10.2 -1.36 0
373964 131321745 1 NOBr2H9C11 ABC2D9E11 11.48 3.37 -10.33 -1.51 0
373965 131321786 1 ON2C11H12 AB2C11D12 19.21 4.77 -10.52 -1.41 0
373966 131321787 1 ClON2C7H9 ABC2D7E9 -24.46 3.92 -9.57 -1.19 0
373967 131321810 1 BrOF2C11H11 ABC2D11E11 -121.5 3.51 -9.91 -1.09 0
373968 131321815 1 BrON4H5C8 ABC4D5E8 104.74 10.16 -9.46 -2.3 0
373969 131321828 1 NOC14H23 ABC14D23 -60.83 2.22 -8.53 0.54 0
373970 131321852 1 O2N3C11H17 A2B3C11D17 -61.53 4.31 -9.55 -0.86 0
373971 131321878 1 OSN2C10H16 ABC2D10E16 -24.87 3.11 -8.15 -0.74 0
373972 131321879 1 OSN2C10H16 ABC2D10E16 -29.95 4.92 -7.97 -0.05 0
373973 131321884 1 OSN2C10H16 ABC2D10E16 -41.25 2.84 -8.1 0.06 0
373974 131321909 1 ClN2O2F3H4C8 AB2C2D3E4F8 -199.07 5.73 -10.17 -1.99 0
373975 131321932 1 ClN2O2F3H4C8 AB2C2D3E4F8 -186.09 4.64 -10.06 -1.7 0
373976 131321936 1 NO2C11H15 AB2C11D15 -79.59 1.66 -8.65 0.38 0
373977 131321959 1 ClINO3H9C10 ABCD3E9F10 -91.97 6.2 -9.35 -1.37 0
373978 131321963 1 BrFOSH10C11 ABCDE10F11 -51.78 1.78 -8.71 -0.74 0
373979 131321964 1 BrFOSH10C11 ABCDE10F11 -51.26 1.85 -8.43 -0.81 0
373980 131321978 1 FSO2H11C12 ABC2D11E12 -109.19 4.79 -9.01 -0.98 0
373981 131321992 1 FSO2H11C12 ABC2D11E12 -110.9 5.07 -9.13 -0.94 0
373982 131322024 1 SO3H10C11 AB3C10D11 -102.04 4.57 -9.06 -1.1 0
373983 131322027 1 SO3H10C11 AB3C10D11 -100.17 4.97 -8.87 -1.0 0
373984 131322031 1 BrN2O4C7H7 AB2C4D7E7 -137.08 3.61 -11.15 -2.3 0
373985 131322046 1 NO2C9H9 AB2C9D9 -29.74 4.18 -9.69 -0.11 0
373986 131322056 1 BrSO3H5C10 ABC3D5E10 -62.03 4.44 -9.62 -1.57 0
373987 131322065 1 ClNSO2H8C10 ABCD2E8F10 -60.59 5.64 -8.82 -1.21 0
373988 131322070 1 ClNSO2H8C10 ABCD2E8F10 -55.94 5.14 -8.81 -1.31 0
373989 131322076 1 ClNSO2H8C10 ABCD2E8F10 -58.45 5.97 -8.81 -1.48 0
373990 131322102 1 ClNSO2H10C11 ABCD2E10F11 -61.76 3.19 -8.79 -0.98 0
373991 131322104 1 ClNSO2H8C10 ABCD2E8F10 -60.27 7.49 -8.76 -1.14 0