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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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144805 53415721 1 SN2O2C16H18 AB2C2D16E18 -22.75 3.13 -8.58 -0.4 0
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144806 53415722 1 NSO2C17H19 ABC2D17E19 -30.94 4.33 -8.54 -0.34 0
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144807 53415723 1 N2O4H8C13 A2B4C8D13 3.27 2.49 -10.41 -2.14 0
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144808 53415776 1 ClNF3C5H9 ABC3D5E9 -196.33 3.61 -10.04 1.62 0
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144809 53415839 1 SO3H14C15 AB3C14D15 -63.92 2.92 -8.88 -0.72 -1
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144811 53415893 2 ClNH2C4 ABC2D4 49.14 3.42 -9.82 -1.56 0
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144812 53415894 1 Cl2N2H4C7 A2B2C4D7 73.5 2.85 -10.12 -1.6 0
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144813 53416941 1 ClNO2C15H20 ABC2D15E20 -85.11 2.63 -9.1 -0.16 0
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144814 53417050 1 FO2N3C6H6 AB2C3D6E6 34.91 4.33 -9.84 -1.69 0
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144815 53417051 1 FO2N3H6C7 AB2C3D6E7 -6.16 2.53 -10.24 -2.0 0
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144816 53417431 1 N2O2F3H7C8 A2B2C3D7E8 -210.88 5.35 -9.47 -1.14 0
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144817 53417732 1 ON2C12H16 AB2C12D16 -31.58 3.25 -9.44 0.11 0
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144818 53417733 1 ON2C11H14 AB2C11D14 -28.12 3.89 -9.49 -0.16 0
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144819 53418453 1 ClON3H10C13 ABC3D10E13 58.8 5.46 -8.87 -1.03 0
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144820 53418511 1 ClNO2H8C10 ABC2D8E10 -65.91 8.24 -8.98 -0.82 0
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144821 53419352 2 OF3H5C6 AB3C5D6 -398.02 4.68 -10.75 -1.23 0
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144822 53419356 1 Cl2O2C11H12 A2B2C11D12 -104.71 1.54 -9.43 -0.44 0
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144823 53419544 1 NO5C11H19 AB5C11D19 -239.2 6.4 -10.15 0.08 0
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144824 53419545 1 ClN2O4C12H15 AB2C4D12E15 -170.8 3.25 -9.66 -1.2 0
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144825 53419876 1 ClO2N6C14H17 AB2C6D14E17 51.49 6.63 -9.43 -1.4 0
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144826 53420311 1 ClN2F3H4C6 AB2C3D4E6 -138.76 3.86 -9.24 -1.02 0
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144827 53420312 2 NOC4H5 ABC4D5 -62.78 2.56 -9.02 -0.7 0
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144828 53420599 1 NPO5C10H22 ABC5D10E22 -308.15 5.67 -10.43 0.71 0
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144829 53420802 2 OC9H14 AB9C14 -79.96 5.02 -9.48 0.53 0
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144830 53420904 1 Cl2N2O2C13H18 A2B2C2D13E18 -23.49 28.05 -7.27 -3.4 -2