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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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24071 607706 3 OH4C5 AB4C5 -68.53 4.34 -9.65 -0.8 0
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24072 607714 1 O4N5C12H13 A4B5C12D13 4.56 8.14 -9.35 -0.94 0
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24073 607716 3 OH4C5 AB4C5 -70.19 3.53 -9.64 -0.74 0
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24074 607719 1 NO3H19C20 AB3C19D20 -51.08 5.19 -9.05 -0.74 0
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24075 607734 2 FN2C4H4 AB2C4D4 -14.85 0.03 -8.59 0.19 0
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24076 607738 1 S3H6C8 A3B6C8 68.21 1.67 -8.65 -0.58 0
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24077 607739 1 N2O5H6C7 A2B5C6D7 -104.08 6.79 -10.47 -2.08 0
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24078 607750 2 ClNH2C4 ABC2D4 47.53 1.42 -9.97 -1.53 0
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24079 607760 1 SN2C13H14 AB2C13D14 63.09 3.46 -8.11 -0.68 0
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24080 607763 1 OC14H14 AB14C14 -23.01 1.69 -8.26 -0.22 0
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24081 607768 1 SN2O5C10H10 AB2C5D10E10 -114.24 4.09 -9.89 -1.71 0
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24082 607776 1 OC14H14 AB14C14 18.92 1.15 -8.99 0.36 0
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24083 607778 1 OC14H14 AB14C14 59.63 6.63 -8.94 -1.23 0
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24084 607780 3 OH4C5 AB4C5 -23.59 3.04 -8.21 -0.63 0
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24085 607792 1 SN2O4C10H14 AB2C4D10E14 -170.09 3.05 -9.76 -1.47 0
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24086 607799 1 N2C13H14 A2B13C14 34.04 1.73 -7.97 0.25 0
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24087 607801 1 FNH10C13 ABC10D13 25.02 2.68 -9.1 -0.75 0
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24088 607809 1 NOC13H13 ABC13D13 10.0 1.81 -8.69 -0.02 0
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24089 607810 1 BrNOSH12C19 ABCDE12F19 48.16 3.05 -8.41 -0.8 0
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24090 607812 1 ON3C13H15 AB3C13D15 43.47 1.89 -9.35 -0.57 0
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24091 607814 1 N2O3F6H12C15 A2B3C6D12E15 -404.48 7.06 -9.26 -0.93 0
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24092 607823 1 BrON2H3C6 ABC2D3E6 83.16 3.88 -9.93 -1.76 0
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24093 607827 1 NiO4C16H26 AB4C16D26 -116.29 3.92 -8.24 0.07 -6
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24094 607834 1 ClNOSH16C19 ABCDE16F19 30.09 5.24 -8.86 -0.9 0
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24095 607838 1 O3H10C14 A3B10C14 -53.15 4.48 -9.36 -1.63 0
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24096 607840 1 SN4O6C13H18 AB4C6D13E18 -182.2 8.19 -8.88 -1.33 0
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24097 607843 1 NOC15H17 ABC15D17 -24.92 5.92 -8.54 -0.31 0
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24098 607845 1 O4H10C13 A4B10C13 -109.18 3.55 -10.51 -1.99 0
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24099 607848 1 O2N3C26H35 A2B3C26D35 -99.25 5.93 -8.39 -0.16 0
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24100 607849 1 CoOPC15H24 ABCD15E24 -19.52 44.78 -11.17 -6.02 -5
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24101 607853 1 NSSiC12H27 ABCD12E27 -52.23 1.63 -8.16 0.6 0
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24102 607854 3 NO2C7H7 AB2C7D7 -134.79 6.43 -9.63 -1.49 0
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24103 607857 1 NOSH15C16 ABCD15E16 32.43 6.63 -7.95 -0.16 0
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24104 607862 1 Cl2O2H10C13 A2B2C10D13 -43.57 3.35 -8.97 -0.47 0
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24105 607867 1 NO2H17C19 AB2C17D19 3.7 0.97 -8.95 -0.39 0
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24106 607877 1 SO2N3H11C19 AB2C3D11E19 71.85 3.98 -8.83 -1.66 0
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24107 607882 2 ClOH6C7 ABC6D7 -63.59 1.23 -9.08 -0.11 0
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24108 607883 1 ClN2O2H7C11 AB2C2D7E11 -26.21 5.55 -9.3 -1.33 0
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24109 607884 1 OSiC20H42 ABC20D42 -175.93 1.88 -9.13 1.38 0
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24110 607885 1 SO3H5N5C6 AB3C5D5E6 11.18 3.04 -10.03 -1.34 0
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24111 607886 1 SN2O2C18H18 AB2C2D18E18 -30.87 2.23 -8.64 -0.69 0
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24112 607891 2 O2S2C11H12 A2B2C11D12 -140.67 8.0 -8.83 -1.17 0
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24113 607895 1 NS2O3C17H19 AB2C3D17E19 -102.85 3.06 -8.71 -0.78 0
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24114 607900 1 O2F3C15H17 A2B3C15D17 -236.04 1.74 -10.13 -1.15 0
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24115 607901 1 O2N3C20H41 A2B3C20D41 -155.53 1.99 -9.18 0.96 0
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24116 607903 1 ClSN2O2C13H15 ABC2D2E13F15 -60.28 3.02 -9.17 -1.14 0
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24117 607907 1 BSiO2C11H25 ABC2D11E25 -193.84 2.51 -8.63 1.11 0
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24118 607911 1 O2F3C15H17 A2B3C15D17 -236.36 4.49 -10.08 -1.15 0
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24119 607912 1 O2F3C18H23 A2B3C18D23 -250.61 4.4 -10.01 -1.26 0
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24120 607914 1 NSiO4C13H25 ABC4D13E25 -222.37 4.16 -9.51 0.78 0