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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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84043 49863726 1 NO3C19H23 AB3C19D23 -82.08 3.17 -8.78 -0.88 0
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84044 49863775 1 O3N4C30H40 A3B4C30D40 -67.81 3.0 -8.1 0.01 0
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84045 49863848 1 OCl3N4C26H31 AB3C4D26E31 -40.94 7.23 -8.52 -0.34 0
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84046 49863862 1 ClN3C19H24 AB3C19D24 20.03 5.7 -8.64 -0.64 0
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84047 49863867 1 OF6N6H12C21 AB6C6D12E21 -223.24 2.4 -9.57 -1.71 0
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84048 49863869 1 ClS2N4O4H13C19 AB2C4D4E13F19 -31.24 10.83 -9.14 -2.43 0
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84049 49863882 1 FSN2O2C15H17 ABC2D2E15F17 2.18 2.43 -8.91 -1.09 0
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84050 49863883 1 FSN2O2C16H19 ABC2D2E16F19 -13.03 3.3 -8.84 -0.95 0
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84051 49863888 1 ClN3C21H28 AB3C21D28 10.24 5.63 -8.68 -0.65 0
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84052 49863889 1 BrF6N6H9C19 AB6C6D9E19 -166.76 4.93 -9.41 -1.83 0
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84053 49863905 1 O15C41H62 A15B41C62 -690.75 2.37 -9.37 -0.42 0
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84054 49863908 1 ClNO5H20C22 ABC5D20E22 -136.56 10.01 -8.88 -0.85 0
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84055 49863911 1 ClO2N3H20C24 AB2C3D20E24 -10.14 2.68 -8.74 -1.5 0
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84056 49863920 1 ClSO2N5C27H32 ABC2D5E27F32 -0.4 11.27 -8.62 -1.02 0
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84057 49863921 1 SN2O5H26C30 AB2C5D26E30 -95.02 10.4 -9.14 -1.23 0
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84058 49863922 1 SN2F3O6C32H33 AB2C3D6E32F33 -330.04 3.56 -8.67 -1.2 0
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84059 49863925 1 ClFNO5H19C22 ABCD5E19F22 -188.98 7.3 -8.46 -0.97 0
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84060 49863951 1 ClFON3H17C21 ABCD3E17F21 -41.72 3.62 -8.79 -1.47 0
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84061 49863963 1 SN15O29C81H105 AB15C29D81E105 -1190.66 11.29 -8.8 -1.21 0
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84062 49863964 1 S2N15O30C81H109 A2B15C30D81E109 -1261.86 8.64 -8.38 -1.24 0
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84063 49863965 1 SN12O25C70H96 AB12C25D70E96 -1098.35 8.87 -8.37 -1.25 0
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84064 49863966 1 NO4C9H11 AB4C9D11 -149.26 1.22 -9.04 -0.42 0
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84065 49863969 1 O3N11C30H43 A3B11C30D43 -62.23 5.27 -8.67 -0.21 0
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84066 49863976 1 NO4H15C18 AB4C15D18 -86.93 5.45 -8.59 -0.89 0
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84067 49863978 1 NO5H17C19 AB5C17D19 -127.41 5.69 -8.61 -0.86 0