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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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398646 135034536 1 SO9C21H26 AB9C21D26 -396.6 3.63 -8.53 0.02 0
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398647 135034547 1 N2O6C17H22 A2B6C17D22 -176.06 2.58 -9.09 -0.13 0
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398648 135034562 1 NOH17C21 ABC17D21 50.41 2.75 -8.06 -1.0 0
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398649 135034564 1 NSiO2C16H31 ABC2D16E31 -158.73 5.23 -8.53 0.4 0
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398650 135034566 3 S2H8C11 A2B8C11 134.66 4.42 -8.09 -1.04 0
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398652 135034576 1 FN3O4C24H24 AB3C4D24E24 -121.3 5.67 -9.14 -0.56 0
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398653 135034589 1 ClFN3O4H23C25 ABC3D4E23F25 -114.42 2.28 -8.56 -0.9 0
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398654 135034594 1 NO4C12H15 AB4C12D15 -79.88 4.69 -9.92 -0.69 0
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398655 135034597 1 BrN2O2C19H19 AB2C2D19E19 -38.88 3.3 -7.98 -0.25 0
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398656 135034602 1 N3O5H17C19 A3B5C17D19 -99.32 7.79 -8.89 -0.7 0
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398657 135034608 1 ClN3O4H16C19 AB3C4D16E19 -74.72 6.47 -9.03 -0.9 0
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398658 135034609 1 BrN3O4H16C19 AB3C4D16E19 -79.77 6.24 -8.65 -0.86 0
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398659 135034612 1 BrN3O4H14C18 AB3C4D14E18 -68.64 7.06 -8.89 -0.91 0
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398660 135034626 2 OC9H11 AB9C11 -47.1 2.46 -9.4 -0.2 0
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398662 135034628 1 NO8C29H35 AB8C29D35 -337.92 2.2 -9.4 -0.61 0
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398663 135034629 1 O4N7H27C32 A4B7C27D32 51.32 4.95 -9.53 -1.37 0
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398664 135034654 1 SN2O3C17H18 AB2C3D17E18 -64.18 8.24 -9.18 -0.55 0
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398665 135034662 1 ClN2O4C23H23 AB2C4D23E23 -129.62 6.55 -9.67 -0.58 0
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398666 135034669 1 BrON2H17C18 ABC2D17E18 14.45 4.76 -8.93 -0.33 0
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398667 135034670 1 BrON2H17C18 ABC2D17E18 13.78 4.14 -9.22 -0.34 0
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398668 135034675 1 ON2C19H20 AB2C19D20 10.47 3.93 -9.34 0.13 0
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398669 135034678 1 ON2H24C25 AB2C24D25 31.19 3.61 -8.55 0.13 0
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398670 135034679 1 ON2H22C24 AB2C22D24 32.08 3.2 -8.74 -0.03 0
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398672 135034747 1 NPO5H20C21 ABC5D20E21 -121.18 5.74 -9.38 -0.59 0
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398673 135034748 1 NPO5C18H22 ABC5D18E22 -163.53 2.09 -9.51 -0.57 0
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398674 135034752 1 OC20H22 AB20C22 -11.17 4.28 -8.88 -0.24 0
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398676 135034757 1 INC16H18 ABC16D18 40.27 1.82 -8.04 -0.84 0
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398677 135034763 1 FOSN2H11C12 ABCD2E11F12 -29.33 4.83 -9.09 -0.68 0
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398678 135034771 1 O11C23H26 A11B23C26 -421.96 4.85 -9.0 -0.9 0
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398679 135034785 1 N2O2C27H36 A2B2C27D36 -56.63 4.44 -8.83 -0.3 0
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398680 135034787 2 NO2H15C17 AB2C15D17 -30.06 3.13 -8.33 -1.24 0
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398681 135034796 1 OSC16H16 ABC16D16 4.09 1.78 -8.73 -0.18 0
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398682 135034800 1 ON6C11H22 AB6C11D22 53.53 3.32 -10.01 -0.41 0
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398683 135034802 1 SN2O4C19H30 AB2C4D19E30 -211.26 2.24 -8.46 -0.24 0
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398684 135034806 1 FNSiO2C32H38 ABCD2E32F38 -138.38 2.34 -8.87 -0.96 0
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398685 135034808 1 FSiN2O2C27H41 ABC2D2E27F41 -132.03 5.31 -8.71 -0.87 0
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398687 135034811 1 ON2H16C18 AB2C16D18 64.38 4.25 -9.86 -0.9 0
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398688 135034816 1 NSO3C23H23 ABC3D23E23 -34.4 8.37 -8.39 -0.5 0
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398689 135034817 2 NO5C19H28 AB5C19D28 -486.7 5.28 -8.75 -0.3 0
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398690 135034835 1 F2N3H5C9 A2B3C5D9 -9.63 3.39 -10.24 -1.38 0
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398691 135034842 1 N3O34C88H121 A3B34C88D121 -1495.21 4.11 -8.96 -0.49 0
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398692 135034843 1 BrO4C12H13 AB4C12D13 -114.63 1.77 -9.55 -0.47 1
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398693 135034845 1 IN3H15C16 AB3C15D16 121.97 6.47 0.0 0.0 0
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398694 135034846 1 TiO4H34C41 AB4C34D41 -20.58 3.67 -6.8 -1.13 0
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398696 135034858 1 ClSO2C17H17 ABC2D17E17 -59.09 3.06 -8.86 -0.29 0
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398697 135034889 1 BrN3H14C22 AB3C14D22 129.44 3.98 -8.8 -1.03 0
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398698 135034890 1 Cl2N2H14C23 A2B2C14D23 94.62 1.99 -8.63 -1.08 0
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398699 135034915 1 O7C13H18 A7B13C18 -309.15 2.45 -10.07 -0.72 0
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398700 135034920 1 ON2H24C25 AB2C24D25 43.06 3.22 -8.41 -0.4 0
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398702 135034926 1 FO2H21C23 AB2C21D23 -6.5 5.8 -9.24 -0.49 0