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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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14865 423037 1 S2N3O9H15C23 A2B3C9D15E23 -4.26 2.56 -8.37 -3.32 0
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14866 423074 1 N2O5H22C24 A2B5C22D24 -152.57 4.26 -8.7 -1.79 0
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14867 423104 1 ClN2O6C18H25 AB2C6D18E25 -130.07 2.22 -8.25 -0.29 0
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14868 423107 1 NC20H23 AB20C23 45.53 1.34 -9.02 0.25 0
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14869 423108 1 SN3O7C8H9 AB3C7D8E9 -119.8 4.33 -10.43 -2.12 0
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14870 423123 1 ClN2O2C23H24 AB2C2D23E24 6.29 8.6 0.0 0.0 1
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14871 423124 1 NSO3C7H9 ABC3D7E9 -109.85 3.08 -8.72 -0.13 0
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14872 423125 1 CuN2O2C22H30 AB2C2D22E30 -21.02 8.49 0.0 0.0 0
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14873 423168 1 ClON6C12H15 ABC6D12E15 24.87 3.85 -9.04 -1.06 0
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14874 423198 1 ClN2O3C29H33 AB2C3D29E33 -87.02 3.65 -8.24 -0.94 0
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14875 423256 1 Cl4N4C17H18 A4B4C17D18 64.43 5.86 -9.12 -1.3 0
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14876 423331 1 NOC17H19 ABC17D19 4.29 3.0 -8.9 0.06 0
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14877 423357 1 ClPBr2C13H17 ABC2D13E17 -9.48 14.17 0.0 0.0 0
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14878 423360 1 OPC12H16 ABC12D16 -17.06 10.93 0.0 0.0 0
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14879 423371 1 ON3C11H13 AB3C11D13 38.03 1.02 -9.14 -0.57 0
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14880 423375 1 SN3C7H13 AB3C7D13 37.21 4.33 -8.05 -0.2 0
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14881 423401 1 PO2N4C13H15 AB2C4D13E15 -46.95 4.4 -8.89 -0.07 0
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14882 423418 1 N2O4C17H20 A2B4C17D20 -133.04 1.92 -8.32 -0.2 0
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14883 423448 1 NOH14C15 ABC14D15 11.17 2.64 0.0 0.0 1
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14884 423466 1 ClNOH16C19 ABCD16E19 39.64 2.53 -8.25 -0.67 0
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14885 423481 1 NO4H14C17 AB4C14D17 -105.93 5.83 0.0 0.0 1
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14886 423484 1 ClNO4C13H13 ABC4D13E13 -12.09 3.72 0.0 0.0 1
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14889 423563 1 NSO9C24H27 ABC9D24E27 -309.49 3.75 -7.58 -0.58 0
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14890 423566 1 N2Cl3C19H21 A2B3C19D21 23.01 2.99 -8.44 -0.54 0
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14891 423571 1 OBr2Cl2N2C20H22 AB2C2D2E20F22 -12.17 3.96 -8.44 -0.71 0
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14892 423575 2 SN2O5C15H19 AB2C5D15E19 -401.25 1.79 -9.04 -1.22 0
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14893 423577 1 N2O3C14H18 A2B3C14D18 -30.89 6.61 -8.92 -1.57 0
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14894 423586 1 H20C27 A20B27 120.14 0.09 -8.98 -0.19 0
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14895 423587 1 ClNOSC16H24 ABCDE16F24 -62.73 3.72 -8.96 -0.5 0
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14896 423596 1 INOC10H13 ABCD10E13 9.31 8.12 0.0 0.0 1
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14897 423598 1 ON2C9H18 AB2C9D18 45.89 1.02 -4.25 1.4 2
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14898 423599 2 PH16C20 AB16C20 186.84 8.8 -5.92 -0.24 0
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14899 423600 1 PC25H30 AB25C30 114.84 9.13 0.0 0.0 0
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14900 423603 2 PO2H20C22 AB2C20D22 24.61 5.34 -5.54 0.05 0
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14901 423607 1 OSi2C11H20 AB2C11D20 -71.12 0.94 -7.87 0.06 0
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14902 423712 2 ClNOC7H7 ABCD7E7 -46.48 3.61 -8.21 -0.26 0
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14903 423716 1 N2O2C15H18 A2B2C15D18 -28.48 2.49 -8.14 0.02 0
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14904 423766 1 N3O5C39H52 A3B5C39D52 -202.68 5.84 0.0 0.0 1
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14905 423974 1 OCl2N5H17C19 AB2C5D17E19 25.35 7.97 -8.84 -0.58 0
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14906 423975 1 OCl3N5H16C19 AB3C5D16E19 18.78 5.48 -8.76 -0.84 0
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14907 423976 1 ClFSO4N6H20C24 ABCD4E6F20G24 -106.25 11.11 -9.03 -1.07 0
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14908 423977 1 BrCl2O2N4H17C20 AB2C2D4E17F20 -30.69 11.34 -9.17 -1.12 0
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14909 423978 1 FSCl2O4N6H19C24 ABC2D4E6F19G24 -111.82 8.32 -8.77 -1.0 0
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14910 423979 1 Cl2O2N4H16C19 A2B2C4D16E19 -8.08 7.19 -9.11 -0.74 0
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14911 423980 1 ClFSO3N5H21C25 ABCD3E5F21G25 -79.82 7.38 -8.93 -1.48 0
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14912 423981 1 N2O2C13H16 A2B2C13D16 -61.4 4.91 -9.42 -1.45 0
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14913 423984 1 S2N3O6C25H29 A2B3C6D25E29 -185.93 4.71 -8.02 -0.9 0
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14914 424008 1 N2C15H22 A2B15C22 2.97 0.6 -7.22 0.78 0
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14915 424051 1 NC14H15 AB14C15 37.58 1.56 -8.0 0.29 0
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14916 424053 1 NC13H13 AB13C13 112.98 2.04 -8.34 -0.21 0