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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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324094 126676912 1 NO4C19H29 AB4C19D29 -196.04 4.77 -8.86 0.06 0
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324095 126676913 1 NO5C20H29 AB5C20D29 -233.39 2.78 -8.78 0.23 0
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324096 126676916 1 NO4C19H29 AB4C19D29 -193.21 5.8 -8.81 0.08 0
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324097 126676917 1 NO5C20H27 AB5C20D27 -214.01 5.72 -8.89 -0.11 0
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324098 126676918 1 NO5C20H29 AB5C20D29 -231.42 3.24 -8.84 0.06 0
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324099 126676919 1 N2O3C22H26 A2B3C22D26 -77.51 7.08 -8.72 -0.4 0
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324100 126676920 1 BrClPN4O10C24H31 ABCD4E10F24G31 -472.66 5.32 -9.57 -1.29 0
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324101 126676922 1 O3N4C28H38 A3B4C28D38 -74.57 2.34 -8.56 -0.63 0
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324102 126676923 1 BrClPN3O9C21H24 ABCD3E9F21G24 -385.75 8.19 -9.76 -1.51 0
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324103 126676924 1 BrClPN4O10C26H33 ABCD4E10F26G33 -460.67 5.52 -9.75 -1.42 0
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324104 126676925 1 N2O4C25H34 A2B4C25D34 -139.8 4.12 -8.91 -0.15 0
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324105 126676926 1 FN2O3C27H29 AB2C3D27E29 -107.98 4.24 -9.03 -0.33 0
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324106 126676931 1 N2O3C24H28 A2B3C24D28 -57.51 4.07 -8.95 -0.68 0
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324107 126676932 3 OH8C9 AB8C9 -45.97 3.07 -8.55 0.26 0
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324108 126676933 1 NO2C9H13 AB2C9D13 -56.66 2.35 -8.98 0.16 0
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324109 126676936 1 N2O3C26H28 A2B3C26D28 -55.55 5.38 -8.83 -0.38 0
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324110 126676937 1 FN2O3C27H29 AB2C3D27E29 -107.8 4.07 -8.97 -0.24 0
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324111 126676938 1 FN2O4C31H37 AB2C4D31E37 -162.07 3.62 -8.91 -0.24 0
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324112 126676941 1 N3O3C29H31 A3B3C29D31 -36.26 6.57 -9.05 -0.83 0
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324113 126676942 1 FOSN2C11H13 ABCD2E11F13 -52.97 1.69 -9.28 -0.7 0
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324114 126676943 1 IOH7C9 ABC7D9 13.49 2.06 -8.82 -0.84 0
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324115 126676945 1 NO4C19H29 AB4C19D29 -195.58 1.32 -9.01 0.08 0
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324116 126676946 1 NO2C13H19 AB2C13D19 -84.15 2.55 -9.02 0.04 0
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324117 126676948 1 SN2O2C13H18 AB2C2D13E18 -48.62 1.61 -9.02 -0.12 1
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324118 126676951 1 O2F4N7H14C18 A2B4C7D14E18 -105.59 6.0 0.0 0.0 0
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324119 126676952 1 NSO6C19H27 ABC6D19E27 -251.03 3.11 -8.71 -0.07 0
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324120 126676954 1 NO4C18H25 AB4C18D25 -172.62 4.9 -8.96 0.0 0
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324121 126676960 1 NO5C26H31 AB5C26D31 -177.81 5.8 -8.8 -0.51 0
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324122 126676963 1 F2N2O3C27H28 A2B2C3D27E28 -155.83 4.26 -9.1 -0.56 0
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324123 126676964 1 N3O4C30H41 A3B4C30D41 -157.84 1.5 -9.03 -0.26 0
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324124 126676967 1 FN2O3C22H25 AB2C3D22E25 -122.52 6.99 -8.91 -0.6 0
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324125 126676968 1 FN2O3C23H27 AB2C3D23E27 -126.49 4.77 -8.72 -0.56 0
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324126 126676971 1 BrClPN4O10C24H31 ABCD4E10F24G31 -471.91 5.72 -9.67 -1.61 0
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324127 126676972 1 ClPN3O8C21H27 ABC3D8E21F27 -402.37 1.7 -9.66 -0.44 0
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324128 126676974 1 IOH7C9 ABC7D9 14.2 2.54 -8.72 -0.78 0
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324129 126676975 1 N7C22H23 A7B22C23 133.72 4.11 -8.44 -0.56 0
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324130 126676977 1 ClO4C5H7 AB4C5D7 -182.03 3.47 -10.94 -0.56 0
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324131 126676983 1 ClPN3O8C21H27 ABC3D8E21F27 -380.34 11.08 -9.72 -0.65 0
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324132 126676984 1 ON8C21H30 AB8C21D30 58.13 1.84 -8.32 0.14 0
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324133 126676985 1 BrClO6C13H14 ABC6D13E14 -239.55 4.59 -9.61 -1.16 0
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324134 126676994 1 BrClN5C11H11 ABC5D11E11 59.43 5.73 -8.17 -0.46 0
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324135 126676997 4 NC2H3 AB2C3 37.46 2.45 -8.49 -0.02 0
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324136 126676999 1 N2O4C19H22 A2B4C19D22 -131.67 3.31 -7.98 -0.9 0
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324137 126677000 2 NO2C12H15 AB2C12D15 -120.85 3.22 -8.85 -0.5 0
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324138 126677004 1 ON2C19H30 AB2C19D30 -40.87 1.19 -8.53 0.34 0
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324139 126677006 1 N3O3C22H31 A3B3C22D31 -119.24 5.89 -9.03 -0.57 0
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324140 126677008 1 BrN2O4C25H29 AB2C4D25E29 -148.48 3.59 -9.06 -0.52 0
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324141 126677009 1 SN3O6C26H33 AB3C6D26E33 -230.09 5.08 -8.89 -0.77 0
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324142 126677019 1 O3N4C13H20 A3B4C13D20 -118.62 4.55 -9.48 -0.31 0
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324143 126677020 1 SN2H18C19 AB2C18D19 69.2 2.13 -8.25 -0.91 0