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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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144858 53425206 1 Cl2N2O3C17H29 A2B2C3D17E29 -149.67 2.58 0.0 0.0 0
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144859 53425565 1 ClNOH8C10 ABCD8E10 3.09 5.87 -8.82 -1.09 0
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144860 53425608 1 IN2S2C27H29 AB2C2D27E29 77.9 7.52 -7.84 -0.92 0
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144861 53425609 1 IN2O2S2C30H35 AB2C2D2E30F35 3.43 21.6 -6.63 -1.48 1
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144862 53425610 1 N2O2S2C30H35 A2B2C2D30E35 -17.57 4.89 0.0 0.0 0
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144863 53425667 1 FCl4H5C12 AB4C5D12 -34.14 2.6 -9.84 -0.9 0
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144864 53425699 1 INOF3H5C7 ABCD3E5F7 -149.81 3.32 -9.62 -1.46 0
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144865 53425823 1 NSF3O3H6C7 ABC3D3E6F7 -243.59 4.77 -9.83 -1.48 1
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144866 53425824 1 N2O4C13H13 A2B4C13D13 -117.47 2.96 0.0 0.0 0
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144867 53426112 1 NC12H15 AB12C15 43.43 3.36 -9.86 -0.02 0
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144868 53426113 2 NOC9H10 ABC9D10 -37.03 3.78 -9.23 -0.27 0
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144869 53426141 2 ClNOC5H5 ABCD5E5 -57.95 6.45 -9.57 -0.94 0
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144870 53426600 2 N2O2C7H10 A2B2C7D10 -21.64 2.92 -10.08 -1.71 1
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144871 53426780 1 NOC14H20 ABC14D20 -7.62 3.04 0.0 0.0 0
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144873 53426782 1 NC14H20 AB14C20 29.01 1.86 0.0 0.0 0
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144874 53426993 1 O3C15H22 A3B15C22 -142.69 5.05 -9.71 -0.01 0
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144875 53426994 1 N2O2C9H10 A2B2C9D10 -48.18 6.58 -9.6 -1.53 0
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144876 53427232 1 SN2O2C7H12 AB2C2D7E12 -97.06 2.76 -9.17 0.17 0
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144877 53427233 1 N2F4C13H16 A2B4C13D16 -200.49 6.58 -8.88 -0.44 0
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144878 53427317 4 OC5H8 AB5C8 -156.63 5.45 -9.83 0.46 0
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144879 53427318 1 BrSiC9H17 ABC9D17 -11.05 3.24 -9.21 0.13 0
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144880 53427494 1 ClO2C11H11 AB2C11D11 -62.6 3.86 -9.73 -0.33 0
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144881 53427610 1 ClNO4C5H6 ABC4D5E6 -116.7 4.81 -10.6 -1.24 0
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144882 53427611 2 OC5H8 AB5C8 -73.93 4.24 -9.91 0.3 0
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144883 53427821 1 OF2C21H32 AB2C21D32 -190.51 3.03 -9.61 -0.26 0
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144884 53427908 1 NPSO5C6H16 ABCD5E6F16 -289.21 3.95 -8.78 0.58 0
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144885 53428218 1 S2O5N6H28C31 A2B5C6D28E31 3.14 5.83 -8.53 -1.7 0
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144887 53428620 1 NO2C21H35 AB2C21D35 -123.44 0.58 -10.51 -0.99 0
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144888 53428621 1 NO2C22H37 AB2C22D37 -117.56 1.7 -10.47 -0.92 0
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144889 53428957 2 C6H13 A6B13 -61.52 0.13 -10.31 4.0 0
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144890 53429197 1 BClO4H8C9 ABC4D8E9 -189.01 4.49 -8.91 -0.87 0
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144891 53429501 2 ClNOC5H5 ABCD5E5 -48.31 4.24 -9.74 -1.11 0
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144892 53429522 1 N2C7H16 A2B7C16 -17.04 0.6 -8.44 2.7 0
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144893 53429523 1 O4H6C11 A4B6C11 -88.93 5.67 -10.92 -3.05 0
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144894 53429524 1 ON2C11H14 AB2C11D14 28.64 2.98 -9.75 -1.0 0
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144895 53429525 1 O3F5H5C9 A3B5C5D9 -365.33 3.6 -10.76 -1.84 0
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144896 53429600 1 SN2O3C13H18 AB2C3D13E18 -87.68 5.82 -9.06 -1.01 0
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144897 53429601 1 Cl2N2C11H12 A2B2C11D12 -16.29 3.41 -9.29 -0.68 0
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144898 53429944 1 ClN2O2H11C13 AB2C2D11E13 -40.13 4.5 -9.7 -0.92 -2
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144899 53429961 1 NF3O6H8C12 AB3C6D8E12 -275.17 3.44 -10.88 -1.77 0
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144900 53429962 1 NF3O6H10C12 AB3C6D10E12 -308.98 1.55 -11.08 -1.87 -2
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144901 53429963 1 NSO8H11C12 ABC8D11E12 -239.82 5.83 -8.69 -1.36 0
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144902 53429964 1 NSO8C12H13 ABC8D12E13 -245.49 2.81 -10.86 -1.9 -2
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144903 53429965 2 NO3H4C6 AB3C4D6 -82.12 2.48 -10.64 -1.93 0
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144904 53429966 2 NO3H5C6 AB3C5D6 -126.46 5.51 -10.73 -2.11 -2
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144905 53429967 2 NO4H5C6 AB4C5D6 -128.37 4.11 -10.97 -1.99 0
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144906 53429968 2 NO4C6H6 AB4C6D6 -170.45 4.94 -10.93 -1.94 -2
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144907 53429969 1 ClNO5H10C12 ABC5D10E12 -117.93 5.29 -9.07 -0.73 -1
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144908 53430428 1 BrNO3H9C10 ABC3D9E10 -95.64 4.44 0.0 0.0 0
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144909 53430649 1 NF2O2H7C8 AB2C2D7E8 -158.23 8.06 -9.35 -0.91 2