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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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23921 607120 1 ClN2O4C15H15 AB2C4D15E15 -102.33 3.61 -9.23 -0.76 0
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23922 607121 1 N3O3H11C16 A3B3C11D16 24.64 1.66 -9.35 -1.38 0
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23923 607122 1 IO7C22H25 AB7C22D25 -275.07 11.29 -10.08 -1.29 0
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23924 607131 1 N2O4C19H22 A2B4C19D22 -76.28 4.41 -8.56 -0.35 0
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23925 607132 2 N2O3H7C8 A2B3C7D8 -43.69 8.27 -9.94 -2.1 0
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23926 607133 1 BrN2O5H15C16 AB2C5D15E16 -150.24 5.07 -9.09 -0.62 0
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23927 607134 1 ClNOSH14C17 ABCDE14F17 1.3 4.73 -8.49 -1.16 0
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23928 607135 1 ClNSO2H12C16 ABCD2E12F16 -20.17 5.43 -8.34 -1.26 0
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23929 607136 1 FNO4C17H18 ABC4D17E18 -151.88 2.94 -8.4 -0.24 0
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23930 607137 1 N4O5C14H16 A4B5C14D16 -120.62 4.88 -9.06 -0.68 0
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23931 607144 1 NO3F5H8C15 AB3C5D8E15 -289.47 2.17 -9.57 -2.04 0
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23932 607148 1 N2O6H12C19 A2B6C12D19 -6.22 4.51 -9.42 -2.38 0
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23933 607150 1 F3N3O3H16C18 A3B3C3D16E18 -134.18 7.75 -9.22 -1.44 0
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23934 607152 2 NO2C12H12 AB2C12D12 -52.81 4.4 -8.46 -0.27 0
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23935 607162 2 NC8H16 AB8C16 -12.92 2.44 -8.84 2.42 0
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23936 607168 1 O3C20H32 A3B20C32 -181.71 7.2 -9.53 0.96 0
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23937 607169 1 N2O2C19H36 A2B2C19D36 -158.14 2.43 -9.13 1.23 0
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23938 607170 1 N2O5C10H10 A2B5C10D10 -109.56 4.02 -9.13 -1.38 0
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23939 607173 1 NO3C13H21 AB3C13D21 -117.32 1.43 -9.87 0.09 0
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23940 607174 1 ClNO2C10H10 ABC2D10E10 -71.09 4.82 -9.32 -0.77 0
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23941 607175 1 N2O5C10H10 A2B5C10D10 -92.04 3.12 -10.17 -2.37 0
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23942 607178 1 O5H8C9 A5B8C9 -162.54 7.44 -9.42 -0.99 0
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23943 607179 1 NF3O3C11H18 AB3C3D11E18 -322.76 3.69 -10.69 -0.24 0
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23944 607180 1 NF3O3C11H18 AB3C3D11E18 -321.65 4.1 -10.68 -0.14 0
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23945 607181 1 FeO5C11H12 AB5C11D12 17.43 1.21 -7.14 0.76 0
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23946 607182 1 N2O2C19H32 A2B2C19D32 -37.27 0.33 -8.0 0.91 0
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23947 607183 2 NOC5H8 ABC5D8 -97.14 6.91 -9.26 -0.24 0
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23948 607186 1 ON3H11C12 AB3C11D12 68.19 2.8 -9.05 -0.81 0
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23949 607187 2 H2N2O2C3 A2B2C2D3 88.41 4.07 -10.12 -1.57 0
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23950 607188 1 O3N4H16C22 A3B4C16D22 3.09 4.31 -9.64 -1.51 0
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23951 607190 1 OSiC11H20 ABC11D20 -91.29 1.17 -9.02 1.22 0
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23952 607191 1 OSiN3C9H17 ABC3D9E17 -71.89 6.0 -8.84 -0.12 0
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23953 607195 1 NSO5C11H11 ABC5D11E11 -174.41 3.37 -10.42 -1.41 0
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23954 607198 1 NO2H15C20 AB2C15D20 16.42 0.83 -8.99 -0.94 0
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23955 607199 1 O3H10C13 A3B10C13 -48.96 3.24 -10.0 -2.02 0
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23956 607203 1 N3O4H13C14 A3B4C13D14 24.59 9.04 -9.79 -1.55 0
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23957 607204 1 OC15H18 AB15C18 -25.05 1.42 -9.4 0.24 0
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23958 607206 1 NO5H21C22 AB5C21D22 -135.09 3.57 -8.68 -0.75 0
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23959 607209 1 FO2N4H5C7 AB2C4D5E7 30.91 3.66 -9.65 -2.01 0
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23960 607216 1 OH24C28 AB24C28 56.57 3.69 -9.09 -0.64 0
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23961 607217 1 O5C14H22 A5B14C22 -258.68 2.81 -10.14 0.53 0
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23962 607220 1 ClNOC11H14 ABCD11E14 -48.66 2.44 -8.8 -0.26 0
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23963 607222 1 NO5C17H19 AB5C17D19 -169.11 4.85 -8.46 -0.72 0
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23964 607225 1 SN2O3C17H24 AB2C3D17E24 -109.46 7.8 -9.81 -1.18 0
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23965 607229 1 FNO3H16C17 ABC3D16E17 -126.89 1.61 -9.89 -0.77 0
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23966 607240 1 NO7C13H15 AB7C13D15 -202.89 4.96 -9.22 -0.81 0
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23967 607244 2 OC4H7 AB4C7 -24.79 3.57 -6.82 -1.11 -4
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23968 607245 1 ON5C9H17 AB5C9D17 -8.59 3.33 -9.03 0.32 0
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23969 607252 1 NSiO3C9H13 ABC3D9E13 -83.59 5.63 -9.76 -1.38 0
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23970 607264 2 NO2C4H4 AB2C4D4 -76.65 5.21 -9.56 -1.47 0