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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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264000 103414799 1 N2Br3O3H9C13 A2B3C3D9E13 -58.32 3.94 -9.22 -1.44 0
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264001 103414902 1 N2S2O3C8H12 A2B2C3D8E12 -76.95 6.67 -9.91 -1.27 0
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264002 103415182 1 SBr2N2O3C13H18 AB2C2D3E13F18 -105.35 3.73 -8.92 -0.35 0
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264003 103415192 1 O3C14H26 A3B14C26 -148.58 2.2 -9.92 1.45 0
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264004 103415244 1 ClO3C15H23 AB3C15D23 -138.0 4.08 -9.31 -0.04 0
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264005 103415283 1 O2S2N4C13H22 A2B2C4D13E22 -55.96 4.72 -8.91 -1.12 0
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264006 103415420 1 Br2O2C15H22 A2B2C15D22 -84.18 1.33 -9.53 -0.17 0
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264007 103415490 2 ON2C6H12 AB2C6D12 -43.79 5.55 -8.91 0.32 0
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264008 103415815 1 OSN2Br3H9C14 ABC2D3E9F14 38.41 2.59 -8.86 -1.24 0
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264009 103415832 1 NO2C13H27 AB2C13D27 -116.86 1.87 -9.27 1.6 0
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264010 103415943 1 NO2C16H33 AB2C16D33 -122.81 1.32 -8.76 1.68 0
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264011 103416039 1 NSO4C13H21 ABC4D13E21 -166.7 5.95 -8.98 -0.15 0
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264012 103416150 1 ClN2O2S2C9H15 AB2C2D2E9F15 -79.23 4.76 -9.84 -1.21 0
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264013 103416406 1 NBr2O2C14H15 AB2C2D14E15 -30.38 2.08 -8.96 -0.95 0
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264014 103416409 1 NBr2O2C14H15 AB2C2D14E15 -32.67 3.2 -8.86 -0.86 0
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264015 103416638 1 Br2O2N5C12H13 A2B2C5D12E13 -2.92 5.08 -8.88 -1.05 0
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264016 103416876 1 OBr2N5C13H17 AB2C5D13E17 37.75 7.49 -9.11 -1.13 0
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264017 103417106 1 SBr2N2O3H10C12 AB2C2D3E10F12 -68.77 4.98 -9.04 -1.3 0
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264018 103417297 1 N2S2O3C13H20 A2B2C3D13E20 -141.09 5.43 -8.22 -0.14 0
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264019 103417695 1 SN3O4C12H19 AB3C4D12E19 -159.89 4.9 -8.36 -0.26 0
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264020 103417711 1 N2S2O4C13H20 A2B2C4D13E20 -143.83 8.13 -8.37 -0.53 0
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264021 103418036 1 OS2N4C14H18 AB2C4D14E18 14.76 4.54 -8.57 -0.74 0
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264022 103418141 1 FON2S2C15H17 ABC2D2E15F17 -54.36 5.62 -8.25 -0.4 0
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264023 103418150 1 FOSN3H14C15 ABCD3E14F15 -22.24 5.95 -8.56 -0.68 0
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264024 103418352 1 SN2O3C13H20 AB2C3D13E20 -137.98 3.89 -8.15 -0.18 0