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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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293800 117402493 1 ON3C15H21 AB3C15D21 -14.06 2.91 -8.79 0.05 0
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293801 117402553 1 ON3C15H21 AB3C15D21 -19.29 3.47 -8.81 0.05 0
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293802 117402666 1 ON3C15H21 AB3C15D21 -5.49 2.09 -8.55 -0.08 0
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293803 117402685 1 ON3C15H21 AB3C15D21 -19.48 4.48 -8.01 0.26 0
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293804 117402697 1 SN3C14H17 AB3C14D17 53.4 2.22 -8.59 -0.34 0
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293805 117402703 1 SN3C14H17 AB3C14D17 70.97 2.89 -8.36 -0.05 0
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293806 117402728 1 NO2S2C11H17 AB2C2D11E17 -69.37 4.92 -8.99 -0.71 0
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293807 117402731 1 NO2S2C11H17 AB2C2D11E17 -69.2 4.78 -9.04 -0.75 0
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293808 117402762 1 NOC17H25 ABC17D25 -50.47 3.5 -8.39 0.4 0
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293809 117402778 1 NOC17H25 ABC17D25 -34.36 2.35 -8.44 0.44 0
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293810 117402787 1 NOC17H25 ABC17D25 -42.42 1.07 -8.96 0.24 0
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293811 117402800 1 NOC17H25 ABC17D25 -8.11 3.22 -8.88 0.33 0
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293812 117402803 1 NOC17H25 ABC17D25 -35.59 2.85 -8.35 0.53 0
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293813 117402812 1 NOC17H25 ABC17D25 -30.68 2.17 -8.81 0.37 0
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293814 117402829 1 NOC17H25 ABC17D25 -46.21 2.42 -9.17 0.43 0
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293815 117402845 1 NOC17H25 ABC17D25 -52.29 1.57 -8.7 0.41 0
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293816 117402855 1 NOC17H25 ABC17D25 -23.52 2.85 -8.76 0.34 0
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293817 117402986 1 NOC17H25 ABC17D25 -40.99 1.7 -9.3 0.24 0
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293818 117403111 1 NC18H29 AB18C29 -26.66 2.12 -8.92 0.5 0
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293819 117403179 1 ClNF2O2H8C11 ABC2D2E8F11 -119.65 4.99 -9.48 -0.71 0
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293820 117403446 1 ClFNO2C12H15 ABCD2E12F15 -136.64 2.63 -9.69 -0.62 0
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293821 117403551 1 ClNF2C13H16 ABC2D13E16 -89.82 2.73 -9.39 -0.42 0
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293822 117403562 1 ClNF2C13H16 ABC2D13E16 -101.94 1.73 -9.57 -0.6 0
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293823 117403586 1 ClNO3C12H18 ABC3D12E18 -109.49 4.93 -8.85 -0.18 0
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293824 117403685 1 ClNSO2C11H14 ABCD2E11F14 -57.05 3.18 -8.49 -0.66 0
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293825 117403844 1 BrFNOC10H11 ABCDE10F11 -62.3 2.94 -9.78 -0.96 0
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293826 117404157 1 BrNSC10H14 ABCD10E14 8.09 2.7 -7.75 -0.28 0
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293827 117404185 1 F2O5H10C11 A2B5C10D11 -264.29 8.2 -9.36 -1.69 0
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293828 117404234 1 F3O3H11C12 A3B3C11D12 -250.24 6.32 -9.21 -0.65 0
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293829 117404238 1 F3O3H11C12 A3B3C11D12 -235.95 4.35 -9.28 -0.7 0
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293830 117404256 1 FO6C11H13 AB6C11D13 -267.14 5.37 -8.75 -0.65 0
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293831 117404273 1 FN2O3H9C13 AB2C3D9E13 -80.41 8.95 -9.72 -1.32 0
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293832 117404275 1 OSN2F3H7C10 ABC2D3E7F10 -88.86 3.19 -8.85 -1.34 0
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293833 117404313 2 FO2C6H7 AB2C6D7 -249.58 1.19 -9.3 -0.6 0
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293834 117404357 1 O5H12C14 A5B12C14 -150.42 4.3 -8.73 -1.04 0
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293835 117404389 1 N2O4H12C13 A2B4C12D13 -91.19 3.27 -8.92 -0.94 0
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293836 117404452 1 O2F3C13H15 A2B3C13D15 -217.99 3.14 -9.51 -0.52 0
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293837 117404492 1 FN2O2H13C14 AB2C2D13E14 -47.49 5.4 -9.09 -0.81 0
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293838 117404546 1 FSO4C11H13 ABC4D11E13 -192.98 7.89 -9.24 -0.78 0
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293839 117404604 1 O4C15H16 A4B15C16 -127.3 5.76 -8.88 -0.52 0
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293840 117404605 1 O4C15H16 A4B15C16 -132.64 2.56 -8.32 -0.52 0
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293841 117405023 1 O3C16H20 A3B16C20 -132.9 4.77 -8.95 -0.13 0
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293842 117405033 1 O3C16H20 A3B16C20 -103.39 3.09 -9.2 -0.17 0
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293843 117405054 1 O3C16H20 A3B16C20 -109.62 2.51 -8.06 0.04 0
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293844 117405084 1 O3C16H20 A3B16C20 -105.91 3.29 -9.41 -0.31 0
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293845 117405095 1 O3C16H20 A3B16C20 -91.64 5.84 -9.28 -0.17 0
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293846 117405113 1 O3C16H20 A3B16C20 -106.08 3.58 -9.42 0.21 0
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293847 117405126 1 O3C16H20 A3B16C20 -113.58 5.1 -8.95 0.06 0
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293848 117405420 1 OSN2C14H16 ABC2D14E16 33.97 3.13 -8.6 -0.74 0
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293849 117405495 1 O2C17H24 A2B17C24 -104.31 4.98 -9.42 0.22 0