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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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150884 53790581 1 NO5C9H9 AB5C9D9 -98.02 5.35 -9.69 -1.77 0
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150885 53790582 1 NSiO3C6H14 ABC3D6E14 -74.04 2.57 0.0 0.0 0
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150886 53790583 2 O2C21H35 A2B21C35 -248.92 3.46 -9.07 0.15 0
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150887 53790584 1 N2O7C14H18 A2B7C14D18 -286.88 3.36 -9.64 -0.07 0
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150888 53790585 1 FO4C25H33 AB4C25D33 -173.31 4.41 -9.2 -0.35 1
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150889 53790586 1 N4H17C20 A4B17C20 160.55 3.33 0.0 0.0 0
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150890 53790587 2 NO2C6H6 AB2C6D6 -124.75 7.09 -10.33 -0.9 0
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150891 53790588 1 ON4C15H20 AB4C15D20 0.84 1.62 -8.63 -0.6 0
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150892 53790589 1 OPCl2C4H9 ABC2D4E9 -126.74 3.18 -10.78 0.47 0
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150893 53790590 2 N2C10H21 A2B10C21 -66.09 2.32 -8.61 3.08 0
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150894 53790591 1 N2O7C12H14 A2B7C12D14 -196.24 5.02 -8.48 -1.01 0
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150895 53790592 1 FSN3O6C17H22 ABC3D6E17F22 -271.26 5.4 -9.3 -0.66 0
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150896 53790593 1 OF4H6C10 AB4C6D10 -162.38 1.73 -10.54 -1.01 0
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150897 53790594 1 N3O5C25H31 A3B5C25D31 -178.85 5.69 -9.14 -0.37 0
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150898 53790595 1 O3N5C20H23 A3B5C20D23 -13.17 3.1 -9.46 -1.22 0
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150899 53790596 1 SN3O3H19C22 AB3C3D19E22 15.76 5.56 -8.43 -1.04 0
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150900 53790597 1 BrO2C26H27 AB2C26D27 -5.16 4.34 -8.34 -0.08 0
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150901 53790598 1 FNSO2H12C17 ABCD2E12F17 -44.75 2.4 -9.21 -1.31 0
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150902 53790599 1 NC12H21 AB12C21 -19.99 1.65 -8.32 3.03 0
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150903 53790600 1 O2C11H14 A2B11C14 -61.06 2.0 -10.15 -1.05 0
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150904 53790601 1 ClSN2C36H43 ABC2D36E43 37.98 2.45 -7.77 -0.12 0
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150905 53790602 1 N5O10C26H41 A5B10C26D41 -461.93 14.44 -9.85 -0.14 0
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150906 53790603 1 NO2C20H27 AB2C20D27 -55.2 1.65 -8.44 0.02 0
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150907 53790604 1 N2O2F6H16C23 A2B2C6D16E23 -221.01 8.96 -9.36 -0.53 0
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150908 53790605 1 BrN2O4C17H25 AB2C4D17E25 -147.32 5.25 -8.66 -0.58 0