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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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404711 135069817 1 O4C19H20 A4B19C20 -94.0 2.98 -8.75 -0.21 0
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404712 135069819 1 SN3O10H27C30 AB3C10D27E30 -182.94 2.26 -8.57 -2.04 0
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404713 135069820 1 O4C19H22 A4B19C22 -147.69 6.08 -9.03 -0.21 0
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404714 135069822 1 OF2N2H34C42 AB2C2D34E42 2.17 6.22 -8.27 -0.25 0
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404715 135069823 1 OC13H14 AB13C14 26.68 1.89 -9.28 -0.19 0
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404716 135069825 1 NOSiH25C28 ABCD25E28 26.08 3.75 -9.32 -0.64 0
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404717 135069829 1 NO2C33H39 AB2C33D39 -41.88 3.41 -9.34 0.13 0
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404718 135069936 1 OC15H24 AB15C24 -70.89 4.89 -9.72 0.03 0
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404719 135069959 1 FN2O4H23C32 AB2C4D23E32 -57.47 4.39 -8.52 -1.1 0
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404720 135069960 1 ClN2O4H23C32 AB2C4D23E32 -19.44 3.98 -8.62 -1.21 0
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404721 135069963 1 BFN3O5C31H33 ABC3D5E31F33 -262.05 5.02 -9.64 -1.3 0
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404722 135069964 1 FN3O4H24C26 AB3C4D24E26 -128.47 6.2 -8.92 -1.66 0
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404723 135069965 1 FNSO6C23H28 ABCD6E23F28 -285.93 3.89 -9.46 -0.64 0
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404724 135069966 1 OC17H28 AB17C28 -72.42 3.5 -9.49 -0.12 0
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404725 135069967 1 O4C33H42 A4B33C42 -135.59 5.14 -8.95 -0.96 0
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404726 135069971 1 O4C17H20 A4B17C20 -129.99 2.39 -10.15 -0.86 0
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404727 135069972 1 BrSN3O6C26H34 ABC3D6E26F34 -169.64 9.3 -9.64 -1.77 0
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404728 135070088 2 NO2C6H7 AB2C6D7 -128.82 1.17 -8.95 -0.69 0
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404729 135070105 2 NO8C13H19 AB8C13D19 -748.01 7.57 -9.66 0.2 0
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404730 135070108 1 O3C4N4H8 A3B4C4D8 -62.77 2.95 -10.37 -0.58 0
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404731 135070109 1 N2O13C20H28 A2B13C20D28 -476.79 9.18 -9.94 -1.19 0
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404732 135070110 1 O17C27H30 A17B27C30 -671.9 1.19 -9.33 -1.44 0
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404733 135070112 1 OC40H60 AB40C60 -21.91 1.6 -8.13 0.39 0
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404734 135070113 2 OC20H31 AB20C31 -89.36 3.5 -8.08 0.13 0
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404735 135070114 1 OC40H58 AB40C58 -1.57 2.75 -7.98 0.24 0
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404736 135070115 2 OC20H30 AB20C30 -66.01 1.54 -8.36 0.23 0
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404737 135070250 1 FOC29H33 ABC29D33 -37.41 2.56 -8.86 0.12 0
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404738 135070251 2 O2C5H5 A2B5C5 -143.63 4.2 -10.52 -0.44 0
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404739 135070252 1 O5C14H22 A5B14C22 -238.75 2.52 -10.2 0.12 0
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404740 135070253 2 F2H4C5 A2B4C5 -181.61 3.04 -9.74 -0.28 0
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404741 135070255 1 ClNO2C18H20 ABC2D18E20 -57.28 1.21 -9.25 -0.32 0
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404742 135070256 1 NOC9H13 ABC9D13 -38.0 4.15 -8.76 0.96 0
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404743 135070365 1 N3O3C11H11 A3B3C11D11 4.14 1.24 -9.27 -0.82 0
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404744 135070384 1 N5O16C24H41 A5B16C24D41 -662.43 3.9 -10.22 -0.32 -2
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404745 135070388 1 PC9O10H17 AB9C10D17 -410.22 2.56 -9.78 -1.8 0
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404746 135070389 1 PC9O10H19 AB9C10D19 -522.44 10.42 -10.63 -0.6 0
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404747 135070390 2 NO6C9H15 AB6C9D15 -570.06 3.75 -10.28 -0.25 0
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404748 135070391 1 N2O9C15H26 A2B9C15D26 -434.0 1.33 -10.14 0.11 0
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404749 135070392 1 O8C15H20 A8B15C20 -339.76 3.53 -9.61 -0.13 0
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404750 135070418 1 ClSN2O2H9C11 ABC2D2E9F11 -23.01 6.2 -8.85 -1.16 0
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404751 135070508 1 NOC22H25 ABC22D25 -4.68 3.26 -9.17 -0.1 0
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404752 135070513 1 BrO2F3H10C11 AB2C3D10E11 -231.8 3.38 -9.86 -0.67 0
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404753 135070516 1 SiN2O6C34H44 AB2C6D34E44 -224.39 4.17 -8.95 -0.14 0
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404754 135070519 1 SO2N3H17C18 AB2C3D17E18 55.83 7.78 -9.58 -0.75 0
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404755 135070520 1 O3C12H14 A3B12C14 -104.1 1.95 -9.79 -0.14 0
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404756 135070524 1 ClO3C13H15 AB3C13D15 -120.12 2.37 -9.54 -0.4 0
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404757 135070525 1 OC21H26 AB21C26 -22.07 2.67 -9.36 -0.56 0
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404758 135070526 1 NOC15H21 ABC15D21 -35.97 2.58 -8.78 0.32 0
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404759 135070527 1 FN2O3C10H11 AB2C3D10E11 -164.11 4.95 -10.08 -0.54 0
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404760 135070532 1 OSN2F3C9H15 ABC2D3E9F15 -183.95 4.31 -8.96 -0.21 0