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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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146970 53776839 2 O2N3H23C25 A2B3C23D25 83.46 2.0 -8.71 -0.4 0
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146971 53776843 1 O5C24H26 A5B24C26 -113.84 5.49 -9.28 -0.82 0
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146972 53776845 2 NO2C10H11 AB2C10D11 -124.71 4.82 -9.2 -1.05 0
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146973 53776849 1 O3F4N4H22C26 A3B4C4D22E26 -176.38 1.96 -8.68 -0.93 0
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146974 53776857 1 SN3O3C17H21 AB3C3D17E21 -79.34 0.69 -9.19 -0.53 0
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146975 53776873 1 NO2C14H21 AB2C14D21 -76.38 3.8 -8.17 0.31 0
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146976 53776894 1 N2O2H18C21 A2B2C18D21 29.22 5.27 -8.85 -0.46 0
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146977 53776896 1 O3C23H48 A3B23C48 -238.58 3.86 -10.01 2.72 0
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146978 53776899 1 NO7C30H41 AB7C30D41 -303.16 5.52 -9.62 -0.04 0
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146979 53776904 1 BrClO2C4H6 ABC2D4E6 -88.19 2.64 -10.31 -0.79 0
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146980 53776905 1 SO3N4C22H26 AB3C4D22E26 -77.35 8.84 -8.46 -0.31 0
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146981 53776909 1 SO3C7H10 AB3C7D10 -129.44 2.66 -9.14 -0.41 0
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146982 53776912 1 SBr2O4H20C28 AB2C4D20E28 -51.58 4.66 -9.92 -1.14 1
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146983 53776914 1 S2O3N4C32H37 A2B3C4D32E37 -31.11 4.76 0.0 0.0 0
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146984 53776918 1 O3H32C34 A3B32C34 -44.24 2.71 -9.4 -0.18 0
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146985 53776920 1 N5O5C22H25 A5B5C22D25 -97.06 2.55 -7.4 -0.22 0
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146986 53776921 1 NO2C12H13 AB2C12D13 -45.58 3.64 -8.1 -0.55 0
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146987 53776923 1 SO2N3H9C11 AB2C3D9E11 46.86 4.5 -9.13 -1.63 0
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146988 53776931 1 SN6O7C27H34 AB6C7D27E34 -212.51 6.59 -8.68 -0.84 0
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146989 53776933 1 ON5C22H25 AB5C22D25 98.05 4.6 -8.31 -0.88 0
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146990 53776935 1 NO3S3H11C13 AB3C3D11E13 -41.53 2.9 -8.71 -1.37 0
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146991 53776943 1 N2O3S3H18C20 A2B3C3D18E20 3.49 3.11 -8.26 -1.09 0
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146992 53776957 1 NSO2C26H29 ABC2D26E29 -29.24 3.83 -8.86 -0.75 0
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146993 53776958 1 BrO2C15H15 AB2C15D15 -46.99 2.93 -8.97 -0.6 0
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146994 53776963 1 N2O5C21H38 A2B5C21D38 -279.59 7.95 -9.83 -0.01 0