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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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43711 10321681 1 S2O3N5H19C21 A2B3C5D19E21 8.37 3.22 -8.72 -1.4 0
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43712 10321682 1 O2F3N3C24H34 A2B3C3D24E34 -253.83 1.39 -9.2 -1.08 0
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43713 10321683 1 SN3O4C24H27 AB3C4D24E27 -88.46 6.62 -8.7 -0.58 0
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43714 10321686 1 S2N3O3C23H23 A2B3C3D23E23 -55.53 2.5 -8.49 -0.9 0
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43715 10321688 1 NSiO5C25H31 ABC5D25E31 -143.87 5.74 -8.93 -1.2 0
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43716 10321691 1 NS2O3C25H27 AB2C3D25E27 -87.21 7.71 -8.99 -0.64 0
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43717 10321692 1 ON3C30H35 AB3C30D35 45.1 3.4 -8.32 -0.68 0
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43718 10321693 1 NPS2O4C20H40 ABC2D4E20F40 -271.81 4.16 -8.95 -0.1 0
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43719 10321694 1 SO2N3C26H35 AB2C3D26E35 -30.25 4.6 -8.5 -0.42 0
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43720 10321695 1 NO3C29H43 AB3C29D43 -157.88 4.71 -8.66 -0.57 0
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43721 10321696 1 NOC32H39 ABC32D39 2.81 2.44 -8.46 0.22 0
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43722 10321697 1 O2N3C28H43 A2B3C28D43 -111.88 2.05 -9.15 0.11 0
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43723 10321698 1 NSO2C28H39 ABC2D28E39 -55.15 2.34 -8.27 0.32 0
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43724 10321699 1 NSiO3C27H39 ABC3D27E39 -161.2 2.36 -8.83 -0.22 0
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43725 10321700 1 ClINO4C16H21 ABCD4E16F21 -181.59 5.26 -9.48 -1.32 0
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43726 10321701 1 N2Cl3O3H19C21 A2B3C3D19E21 -69.1 8.54 -8.65 -1.19 0
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43727 10321703 1 ClNO7C22H28 ABC7D22E28 -81.96 26.17 -9.86 -2.54 0
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43728 10321707 1 ClSO2N5H20C22 ABC2D5E20F22 40.1 7.14 -8.77 -0.84 0
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43729 10321709 1 ClNO4C26H28 ABC4D26E28 -146.0 3.99 -8.87 -0.82 0
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43730 10321710 1 ClS2N3O4C19H20 AB2C3D4E19F20 -107.95 4.86 -8.62 -1.06 0
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43731 10321713 1 SCl4F4H4N4C12 AB4C4D4E4F12 -119.32 6.45 -9.86 -2.08 0
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43732 10321714 1 ICl2N3H10C17 AB2C3D10E17 99.55 3.72 -8.6 -1.7 0
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43733 10321715 1 OBr2N2C19H22 AB2C2D19E22 20.28 3.41 -8.76 -0.54 0
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43734 10321716 1 OBr2C21H26 AB2C21D26 130.19 30.68 -5.78 -4.39 1
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43735 10321717 1 BrOC21H26 ABC21D26 -13.3 5.32 0.0 0.0 0
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43736 10321718 1 Cl2N3O3H17C23 A2B3C3D17E23 -31.84 8.62 -8.9 -0.86 0
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43737 10321719 1 Cl2N3O3H17C23 A2B3C3D17E23 -22.82 11.17 -9.42 -1.48 0
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43738 10321721 1 Cl2S2N3O3H13C18 A2B2C3D3E13F18 -34.09 3.75 -9.09 -0.93 0
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43739 10321722 1 BrON5C22H24 ABC5D22E24 35.24 5.82 -8.81 -1.11 0
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43740 10321724 1 NCl2O2H25C26 AB2C2D25E26 -54.46 4.82 -8.98 -0.24 0
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43741 10321725 1 ON2F6H20C23 AB2C6D20E23 -302.71 7.65 -9.64 -1.52 0
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43742 10321726 1 PO7H23C24 AB7C23D24 -279.05 2.72 -9.6 -0.78 0
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43743 10321727 1 SN4O6H18C21 AB4C6D18E21 -53.57 6.26 -8.71 -1.93 0
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43744 10321728 1 O8C25H26 A8B25C26 -277.09 8.24 -8.81 -1.06 0
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43745 10321729 1 N4O6C23H26 A4B6C23D26 -128.3 11.51 -9.04 -1.36 0
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43746 10321730 1 F3O3H25C27 A3B3C25D27 -214.25 3.58 -9.48 -0.38 0
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43747 10321731 2 ON4H11C12 AB4C11D12 105.19 9.13 -9.31 -1.44 0
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43748 10321734 1 F3N6C24H25 A3B6C24D25 -59.94 7.98 -9.18 -0.89 0
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43749 10321735 1 SN2O4H18C26 AB2C4D18E26 -57.38 5.54 -8.36 -0.97 0
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43750 10321736 1 SN4O5C22H22 AB4C5D22E22 -92.35 9.38 -9.33 -1.07 0
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43751 10321737 1 SN4O5C22H22 AB4C5D22E22 -137.77 3.5 -9.1 -0.79 0
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43752 10321738 1 O3N4H26C27 A3B4C26D27 -11.96 5.45 -8.97 -0.44 0
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43753 10321739 1 O3N4H26C27 A3B4C26D27 1.98 4.47 -8.24 -1.11 0
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43754 10321741 1 ON8C25H26 AB8C25D26 123.99 2.29 -8.93 -1.26 0
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43755 10321742 1 FN2O4C26H31 AB2C4D26E31 -168.25 4.6 -8.42 -0.66 0
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43756 10321744 2 NO2C10H13 AB2C10D13 -159.02 6.66 -8.54 -0.12 0
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43757 10321745 1 SN2O5C24H26 AB2C5D24E26 -117.9 8.95 -8.75 -0.63 0
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43758 10321746 1 SO2N4H22C26 AB2C4D22E26 53.38 4.46 -9.26 -1.3 0
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43759 10321747 1 O6C27H34 A6B27C34 -203.09 3.63 -9.27 -0.75 0
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43760 10321749 1 SF2N2O5C20H36 AB2C2D5E20F36 -381.53 6.42 -8.72 0.51 0