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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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165917 74614492 1 SF2N3O5C23H25 AB2C3D5E23F25 -240.82 4.99 -8.87 -1.19 0
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165918 74614493 1 SF2N4O6C20H20 AB2C4D6E20F20 -215.28 2.14 -9.47 -1.65 0
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165919 74614559 1 FN3O3C20H26 AB3C3D20E26 -134.48 5.2 -8.87 -0.72 0
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165920 74614560 1 SO4N5C22H29 AB4C5D22E29 -105.06 13.72 -9.34 -0.96 0
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165921 74614561 1 OS3N5H15C17 AB3C5D15E17 103.81 5.45 -8.51 -1.25 0
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165922 74614619 1 N3O4H23C24 A3B4C23D24 -82.04 1.84 -8.92 -0.67 0
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165923 74614620 1 N3O4C24H27 A3B4C24D27 -91.97 6.23 -9.56 -1.5 0
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165924 74614621 1 ClN2O4H15C19 AB2C4D15E19 -40.35 4.75 -9.25 -1.11 0
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165925 74614918 1 ClNSO7C23H26 ABCD7E23F26 -236.34 8.12 -8.82 -1.45 0
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165926 74615127 1 N3O5C23H25 A3B5C23D25 -85.24 5.16 -8.07 -1.76 0
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165927 74615128 1 BrN3O4C20H20 AB3C4D20E20 -52.51 4.57 -9.16 -1.64 0
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165928 74615129 1 IN3O3H18C19 AB3C3D18E19 -3.64 3.87 -9.47 -1.5 0
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165929 74615130 1 N3O3C21H23 A3B3C21D23 -39.13 4.75 -9.27 -1.75 0
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165930 74616190 1 N3O4C24H33 A3B4C24D33 -132.19 4.55 -8.81 -0.4 0
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165931 74616327 1 N2O5C28H36 A2B5C28D36 -198.15 3.8 -8.69 -0.55 0
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165932 74616328 1 ClN2O5C21H21 AB2C5D21E21 -170.48 3.61 -9.33 -0.51 0
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165933 74616332 1 ClSO2N3C21H22 ABC2D3E21F22 19.51 6.04 -8.8 -0.77 0
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165934 74616504 1 ClN2O6C21H21 AB2C6D21E21 -203.83 6.13 -8.91 -0.54 -1
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165935 74616804 1 FN3O5C27H27 AB3C5D27E27 -135.86 10.49 0.0 0.0 0
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165936 74616843 1 N3O4C25H27 A3B4C25D27 -42.59 17.81 -7.83 -1.13 0
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165937 74616844 1 N2O5H28C30 A2B5C28D30 -55.68 18.15 -8.04 -1.17 0
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165938 74617111 1 FN2O4C19H23 AB2C4D19E23 -168.7 3.81 -8.97 -0.64 0
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165939 74617267 1 N2O9H22C23 A2B9C22D23 -218.76 4.85 -8.3 -1.49 0
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165940 74617497 1 NO7H17C19 AB7C17D19 -154.3 5.27 -9.87 -1.27 0
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165941 74617751 1 SN3O5C24H25 AB3C5D24E25 -111.02 7.91 -8.64 -1.04 0