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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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308775 126522471 1 FON6H21C28 ABC6D21E28 100.77 6.44 -8.64 -1.99 0
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308776 126522482 1 OSN6H26C29 ABC6D26E29 134.71 7.43 -8.57 -1.94 0
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308777 126522589 2 N3H11C12 A3B11C12 168.56 7.98 -8.36 -1.8 0
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308778 126522666 1 O2N7H23C27 A2B7C23D27 139.13 4.43 -8.72 -2.1 0
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308779 126522667 1 FO2N6H31C34 AB2C6D31E34 42.32 7.68 -8.49 -1.83 0
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308780 126522668 1 FSO2N7C34H34 ABC2D7E34F34 53.88 1.17 -8.58 -1.94 0
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308781 126522670 2 N4H8C11 A4B8C11 235.26 3.62 -8.58 -2.06 0
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308782 126522671 1 F2N7C29H29 A2B7C29D29 55.16 8.27 -8.34 -1.77 0
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308783 126522672 1 FON6H25C29 ABC6D25E29 118.35 7.52 -8.48 -1.81 0
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308784 126522673 1 OSN5H17C24 ABC5D17E24 153.94 8.3 -8.57 -1.9 0
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308785 126522674 1 SO2N6H26C30 AB2C6D26E30 99.68 7.41 -8.54 -1.92 0
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308786 126522675 1 SN5H17C24 AB5C17D24 196.84 8.41 -8.56 -1.86 0
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308787 126522678 1 SN5H19C23 AB5C19D23 183.34 6.18 -8.47 -1.83 0
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308788 126522679 1 N8H18C23 A8B18C23 207.62 2.44 -8.7 -2.13 0
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308789 126522682 1 FN6H23C28 AB6C23D28 154.83 6.89 -8.52 -1.86 0
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308790 126522684 1 ON7H23C28 AB7C23D28 154.65 5.69 -8.63 -1.99 0
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308791 126522686 2 N3C12H14 A3B12C14 125.82 6.97 -8.16 -1.58 0
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308792 126522710 1 FSO2N8H27C29 ABC2D8E27F29 68.12 8.15 -8.52 -2.15 0
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308793 126522711 1 FSO2N8H27C29 ABC2D8E27F29 69.54 6.48 -8.42 -2.21 0
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308794 126522713 1 ClN2O2C20H25 AB2C2D20E25 -91.82 6.07 -8.48 -0.18 0
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308795 126522714 1 FSN7H20C25 ABC7D20E25 170.31 6.79 -8.84 -2.26 0
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308796 126522716 1 FN2O2H17C18 AB2C2D17E18 -77.68 1.68 -9.22 -0.81 0
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308797 126522718 1 BrSO4N9C23H32 ABC4D9E23F32 -135.12 3.89 -9.0 -1.1 0
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308798 126522723 1 FON6H21C25 ABC6D21E25 101.82 7.33 -8.65 -2.06 0
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308799 126522726 1 N7H23C27 A7B23C27 207.28 3.15 -8.6 -1.96 0
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308800 126522731 1 SN2O7C12H26 AB2C7D12E26 -362.6 7.3 -10.03 0.3 0
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308801 126522732 2 SO3N4C11H13 AB3C4D11E13 -177.4 6.2 -8.98 -0.89 0
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308802 126522739 1 FN6H17C25 AB6C17D25 153.78 4.72 -8.57 -1.93 0
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308803 126522740 1 ON2C14H18 AB2C14D18 -13.01 4.68 -8.55 -0.98 0
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308804 126522742 2 N3H10C12 A3B10C12 186.94 5.96 -8.54 -1.89 0
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308805 126522743 1 FON6H23C30 ABC6D23E30 114.0 5.72 -8.61 -1.97 0
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308806 126522745 1 N9C26H27 A9B26C27 196.66 5.85 -8.26 -1.65 0
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308807 126522746 1 N2O3C19H24 A2B3C19D24 -101.15 2.51 -8.24 -0.13 0
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308808 126522748 1 OSN6H24C29 ABC6D24E29 154.79 5.42 -8.4 -1.73 1
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308809 126522750 1 PN4O9C14H28 AB4C9D14E28 -436.14 8.65 0.0 0.0 0
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308810 126522783 1 SN5H15C23 AB5C15D23 208.11 4.24 -8.47 -1.83 0
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308811 126522786 1 N3O5C24H33 A3B5C24D33 -205.19 6.61 -8.09 -0.07 0
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308812 126522794 2 N3H11C12 A3B11C12 167.15 7.37 -8.29 -1.7 0
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308813 126522795 1 NaN7O33C60H100 AB7C33D60E100 -1416.01 71.65 -6.93 -2.31 0
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308814 126522796 1 NaN7O33C60H106 AB7C33D60E106 -1473.72 26.29 -8.5 -1.6 1
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308815 126522797 1 N2S2O8C40H49 A2B2C8D40E49 -288.59 4.1 0.0 0.0 0
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308816 126522798 1 OC22H34 AB22C34 -72.05 1.64 -8.37 0.48 0
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308817 126522799 1 NO14C22H33 AB14C22D33 -605.66 6.53 -10.07 -0.11 0
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308818 126522801 1 OSN6H24C32 ABC6D24E32 174.7 10.62 -8.48 -1.81 0
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308819 126522802 2 SO3N4C10H11 AB3C4D10E11 -170.59 8.83 -9.48 -2.48 0
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308820 126522803 1 FON7H28C32 ABC7D28E32 95.59 6.66 -8.64 -1.98 0
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308821 126522804 1 FON5H18C26 ABC5D18E26 113.53 5.37 -8.53 -1.86 0
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308822 126522805 1 NO2C18H25 AB2C18D25 -67.51 2.81 -8.77 0.34 0
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308823 126522807 1 ON7H29C32 AB7C29D32 143.79 7.46 -8.54 -1.89 0
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308824 126522810 1 N3O4C21H27 A3B4C21D27 -158.28 10.26 -8.25 -0.26 0