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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
Show
216898 85086942 1 O3N5C15H15 A3B5C15D15 1.87 10.97 -8.99 -1.43 0
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216899 85086943 1 ON2H16C21 AB2C16D21 67.62 2.84 -9.31 -0.94 0
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216900 85086945 1 NSO4C15H23 ABC4D15E23 -184.75 4.66 -8.96 -0.06 0
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216901 85086947 1 O6H14C17 A6B14C17 -206.86 3.17 -9.85 -2.23 0
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216902 85086948 1 N2O5H14C16 A2B5C14D16 -134.12 3.45 -9.88 -2.21 0
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216903 85086949 1 O7C15H22 A7B15C22 -322.41 4.35 -10.1 -0.19 0
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216904 85086950 2 NO3C7H11 AB3C7D11 -256.47 1.28 -10.31 0.63 0
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216905 85086951 2 NOH7C10 ABC7D10 44.61 10.02 -8.37 -1.75 0
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216906 85086952 2 OSC4N4H5 ABC4D4E5 137.31 3.68 -8.99 -1.6 1
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216907 85086953 1 SN2O5C13H17 AB2C5D13E17 -185.36 6.81 0.0 0.0 0
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216908 85086955 2 O3C8H13 A3B8C13 -291.39 2.53 -10.57 0.29 0
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216909 85086957 1 ON2H18C21 AB2C18D21 26.67 4.04 -8.62 -0.46 0
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216910 85086958 1 ON6C16H22 AB6C16D22 39.29 5.35 -8.8 -0.37 0
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216911 85086959 1 N2O2C19H26 A2B2C19D26 -54.69 2.92 -9.23 0.35 0
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216912 85086960 1 N2S2O3C13H18 A2B2C3D13E18 -90.15 6.29 -9.13 -0.42 0
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216913 85086965 1 ClOSN2H13C16 ABCD2E13F16 28.7 6.35 -8.99 -1.69 0
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216914 85086966 1 ClO2N4C14H23 AB2C4D14E23 -88.6 6.73 -9.13 -0.3 0
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216915 85086967 1 INO2C10H22 ABC2D10E22 -116.69 11.44 -7.62 -0.15 0
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216916 85086971 1 NO5C17H17 AB5C17D17 -68.26 6.08 -8.32 -0.96 0
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216917 85086982 1 ClFO2N3C15H17 ABC2D3E15F17 -100.1 6.26 -9.63 -0.29 0
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216918 85086985 1 N2O4C17H20 A2B4C17D20 -141.26 4.44 -10.28 -1.85 0
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216919 85086987 1 O4C19H24 A4B19C24 -145.77 6.9 -8.8 -0.02 0
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216920 85086989 1 SO3C18H20 AB3C18D20 -76.85 8.38 -9.24 -0.3 0
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216921 85086990 1 S2O6C11H20 A2B6C11D20 -253.6 3.92 -10.43 -0.08 0
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216922 85086991 1 O3C20H28 A3B20C28 -152.76 3.6 -9.34 0.53 0