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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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71402 48414797 1 ON4C21H24 AB4C21D24 99.8 2.79 -9.01 -0.52 0
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71403 48414798 1 SN3O3C18H23 AB3C3D18E23 -21.08 6.81 -9.03 -0.92 0
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71404 48414799 1 N3O3C17H23 A3B3C17D23 -50.28 1.53 -8.74 -0.44 0
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71405 48414800 1 O2N3C19H25 A2B3C19D25 -18.77 1.63 -8.92 -0.32 0
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71406 48414801 1 SO2N3C17H23 AB2C3D17E23 -15.21 5.26 -8.63 -0.98 0
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71407 48414802 1 N2O3C21H30 A2B3C21D30 -60.69 4.17 -8.86 -0.35 0
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71408 48414806 1 N2O3C18H18 A2B3C18D18 -26.24 6.06 -8.81 -1.52 0
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71409 48414807 1 N2O3C19H26 A2B3C19D26 -51.39 5.66 -8.67 -0.14 0
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71410 48414809 1 N3O3C21H23 A3B3C21D23 -17.1 6.49 -8.65 -0.81 0
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71411 48414811 1 FN2O3C20H21 AB2C3D20E21 -48.56 2.47 -9.15 -0.58 0
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71412 48414813 1 ON2C17H22 AB2C17D22 17.14 4.33 -8.78 0.02 0
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71413 48414815 1 N3O3C16H19 A3B3C16D19 22.24 4.55 -9.14 -1.47 0
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71414 48414821 1 O2N3C25H25 A2B3C25D25 49.47 4.96 -8.77 -0.98 0
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71415 48414827 1 O2N3C18H19 A2B3C18D19 4.84 4.33 -9.1 -1.2 0
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71416 48414830 1 FOSN4C21H21 ABCD4E21F21 56.46 3.67 -8.69 -0.95 0
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71417 48414831 1 SN3O3C22H25 AB3C3D22E25 -10.76 6.35 -8.87 -1.0 0
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71418 48414832 1 N2O2C17H22 A2B2C17D22 -10.19 2.23 -8.93 0.1 0
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71419 48414833 1 ON2C17H28 AB2C17D28 -24.58 3.36 -8.83 1.0 0
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71420 48414834 1 OSN4C22H22 ABC4D22E22 115.92 4.36 -8.86 -0.83 0
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71421 48414835 1 OSN3C19H23 ABC3D19E23 41.71 3.34 -8.82 -0.78 0
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71422 48414836 1 ClO2N3C19H24 AB2C3D19E24 -27.45 5.06 -8.97 -0.64 0
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71423 48414837 1 N3O3C18H25 A3B3C18D25 -84.07 1.63 -8.92 0.14 0
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71424 48414839 1 ON2C17H22 AB2C17D22 16.01 3.43 -8.8 -0.05 0
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71425 48414840 1 ON2C17H22 AB2C17D22 15.69 4.0 -8.8 -0.04 0
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71426 48414841 1 ON2C21H22 AB2C21D22 62.47 4.01 -8.88 -0.3 0
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71427 48414843 1 ClON2C16H19 ABC2D16E19 19.69 2.66 -9.07 -0.33 0
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71428 48414844 1 ClN2O2C16H19 AB2C2D16E19 -6.0 2.76 -9.18 -0.47 0
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71429 48414845 1 ON2C16H26 AB2C16D26 -18.68 3.11 -8.83 0.96 0
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71430 48414846 1 N2O2C17H22 A2B2C17D22 -12.69 5.06 -8.76 -0.08 0
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71431 48414848 2 NO2C9H12 AB2C9D12 -74.95 2.97 -8.93 -0.09 0
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71432 48414850 1 N3O3C16H19 A3B3C16D19 22.26 5.04 -9.09 -1.56 0
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71433 48414851 1 ON4C14H18 AB4C14D18 56.1 4.98 -9.05 -0.95 0
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71434 48414855 1 ClN2O2C18H23 AB2C2D18E23 -24.6 2.28 -8.89 -0.25 0
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71435 48414856 1 OCl2N2C16H18 AB2C2D16E18 8.41 1.97 -8.99 -0.57 0
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71436 48414857 1 OF2N2C15H16 AB2C2D15E16 -58.81 3.5 -8.97 -0.78 0
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71437 48414858 1 ON2C17H22 AB2C17D22 17.54 3.95 -8.8 -0.03 0
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71438 48414859 1 N2O3C20H28 A2B3C20D28 -57.15 3.9 -8.31 0.23 0
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71439 48414860 1 N2O2C19H26 A2B2C19D26 -28.07 3.26 -8.78 0.23 0
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71440 48414864 1 FN2O2C16H19 AB2C2D16E19 -52.81 1.8 -8.96 -0.21 0
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71441 48414871 1 SN3O3C19H27 AB3C3D19E27 -53.77 6.93 -9.07 -0.92 0
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71442 48414872 1 ON2C19H20 AB2C19D20 52.54 3.44 -8.85 -0.77 0
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71443 48414875 1 O2N4C25H26 A2B4C25D26 68.32 3.19 -8.76 -0.79 0
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71444 48414877 1 N3O3C22H25 A3B3C22D25 -7.8 4.13 -9.12 -0.35 0
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71445 48414880 1 BrN2O2C16H19 AB2C2D16E19 0.6 2.61 -8.99 -0.41 0
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71446 48414881 1 N2O3C18H24 A2B3C18D24 -46.43 4.02 -8.3 0.22 0
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71447 48414882 1 N2O3C17H22 A2B3C17D22 -37.2 5.46 -8.69 -0.2 0
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71448 48414897 1 ON2C14H24 AB2C14D24 -15.87 3.49 -8.91 1.03 0
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71449 48414898 1 O2N3C23H29 A2B3C23D29 -0.25 2.92 -8.91 -0.46 0
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71450 48414899 1 O2N3C20H21 A2B3C20D21 37.53 3.24 -8.81 -0.71 0
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71451 48414900 1 SO3N4C18H22 AB3C4D18E22 -11.99 6.7 -8.92 -0.98 0