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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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375658 134220706 1 ClNSO3H16C19 ABCD3E16F19 -80.92 5.47 -9.07 -0.99 0
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375659 134220715 1 N3F4O5H27C29 A3B4C5D27E29 -338.12 8.04 -8.24 -0.86 0
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375660 134220719 1 F2N3O4C28H29 A2B3C4D28E29 -195.6 6.71 -8.34 -0.85 0
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375661 134220720 1 BrClSN2O3H14C18 ABCD2E3F14G18 -17.0 2.62 -9.3 -1.35 1
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375662 134220721 1 ON3C16H24 AB3C16D24 6.23 2.89 0.0 0.0 0
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375663 134220722 1 BrClSN2O3H16C24 ABCD2E3F16G24 -26.24 6.22 -9.37 -1.32 0
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375664 134220725 1 SO2N6C22H24 AB2C6D22E24 18.68 10.21 -8.54 -0.79 0
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375665 134220726 1 SO4C20H32 AB4C20D32 -199.54 5.55 -8.78 -0.31 3
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375666 134220729 3 NPO2C20H21 ABC2D20E21 -161.67 2.41 0.0 0.0 0
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375667 134220732 3 O2C7H10 A2B7C10 -196.41 5.9 -10.01 0.73 0
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375668 134220734 2 O6C11H12 A6B11C12 -384.64 2.3 -9.63 -2.16 0
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375669 134220735 1 O2N3C16H27 A2B3C16D27 -93.81 1.24 -8.96 0.92 0
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375670 134220736 2 O3C21H22 A3B21C22 -97.64 4.17 -8.81 -0.59 0
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375671 134220742 2 FS2C22H27 AB2C22D27 -70.72 1.56 -8.16 -1.0 0
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375672 134220743 1 N2S2F3O6C37H41 A2B2C3D6E37F41 -280.37 4.19 -8.92 -0.96 0
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375673 134220745 1 F3N4O6C45H45 A3B4C6D45E45 -188.62 6.85 -9.25 -0.2 0
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375674 134220747 1 ClOSN4H17C20 ABCD4E17F20 96.3 3.54 -8.39 -1.14 0
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375675 134220751 2 O2C8H15 A2B8C15 -214.36 4.29 -9.58 0.41 0
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375676 134220754 1 BrClSN2O3H16C18 ABCD2E3F16G18 -49.82 4.38 -9.4 -1.45 0
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375677 134220758 1 N2O3C15H30 A2B3C15D30 -165.45 6.72 -9.01 0.9 0
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375678 134220760 1 INOC2S3H6 ABCD2E3F6 -27.22 1.54 -9.08 -2.51 0
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375679 134220766 1 OCl2N2H10C18 AB2C2D10E18 26.88 4.7 -8.63 -1.53 3
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375680 134220767 1 N3P3O12H39C40 A3B3C12D39E40 -424.17 1.92 0.0 0.0 0
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375681 134220771 1 BrClNSO2H17C19 ABCDE2F17G19 -26.24 1.97 -8.88 -0.92 0
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375682 134220772 1 BrClNSO4H11C15 ABCDE4F11G15 -112.13 2.38 -9.37 -1.52 0
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375683 134220775 1 NO3C15H31 AB3C15D31 -185.49 1.29 -9.18 0.85 0
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375684 134220789 1 N2F3O6C46H59 A2B3C6D46E59 -322.98 6.54 -9.18 -0.59 0
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375685 134220790 2 O2N3C13H14 A2B3C13D14 -62.53 5.41 -9.15 -0.84 0
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375687 134220800 1 BrN2O5H15C18 AB2C5D15E18 -105.31 1.3 -9.0 -1.3 0
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375688 134220811 1 SN2O2F3H21C22 AB2C2D3E21F22 -18.42 6.29 -6.51 -2.98 0
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375689 134220815 1 NO23C28H49 AB23C28D49 -1025.8 7.55 -9.73 -0.4 0
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375690 134220818 1 INOSC10H14 ABCDE10F14 -17.21 2.99 -9.06 -2.37 0
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375691 134220819 1 OSF3N3H20C21 ABC3D3E20F21 -10.97 5.1 -8.61 -0.95 0
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375692 134220820 1 ClOS2N3C18H18 ABC2D3E18F18 155.82 5.18 -8.32 -0.78 0
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375693 134220824 1 FOSN4H21C22 ABCD4E21F22 61.46 3.97 -8.44 -1.47 0
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375694 134220826 1 ClFSO2N3C21H21 ABCD2E3F21G21 -11.46 5.52 -8.57 -1.06 0
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375695 134220833 1 SCl2N2O2H20C21 AB2C2D2E20F21 121.49 8.49 -6.7 -3.11 0
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375696 134220836 1 NC11H21 AB11C21 -11.78 1.89 -8.31 1.35 0
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375697 134220845 1 OSN2C16H20 ABC2D16E20 35.29 3.86 -8.35 0.09 0
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375698 134220851 1 OS2N3C19H21 AB2C3D19E21 176.45 2.41 -6.42 -2.8 0
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375699 134220854 1 S2N3O3C20H23 A2B3C3D20E23 -55.47 9.4 -9.01 -0.65 0
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375700 134220859 1 S2N3O7C37H49 A2B3C7D37E49 -238.41 10.78 -8.66 -1.25 0
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375701 134220860 1 SN2O8C41H82 AB2C8D41E82 -511.47 3.57 -9.1 0.06 0
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375702 134220871 1 BrClNSF2O2H11C18 ABCDE2F2G11H18 -126.86 3.56 -9.43 -1.44 0
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375703 134220872 1 OSN4C19H22 ABC4D19E22 87.78 3.71 -8.45 -0.46 0
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375704 134220873 1 O2N3C13H29 A2B3C13D29 -128.94 1.88 -8.9 0.68 0
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375705 134220876 1 BrClNSO3H17C20 ABCDE3F17G20 -52.03 5.03 -9.09 -1.38 0
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375706 134220878 1 BrClNSO2H21C22 ABCDE2F21G22 -55.35 4.94 -9.24 -1.33 0
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375707 134220880 1 BrFNSCl2O2H11C18 ABCDE2F2G11H18 -85.85 5.45 -9.37 -1.39 0
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375708 134220887 1 NCl2O2S2F3H12C19 AB2C2D2E3F12G19 -200.74 6.13 -9.51 -1.6 0