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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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294000 117421547 1 FNO3C14H18 ABC3D14E18 -155.17 4.58 -9.06 -0.51 0
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294001 117421579 1 FNO3C14H18 ABC3D14E18 -157.79 6.67 -9.47 -1.02 0
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294002 117421580 1 FNO3C14H18 ABC3D14E18 -140.05 3.44 -8.52 -0.38 0
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294003 117421667 1 NO4C14H21 AB4C14D21 -162.88 4.53 -9.02 -0.2 0
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294004 117421681 1 NO4C14H21 AB4C14D21 -145.93 2.4 -8.3 0.19 0
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294005 117421691 1 NO4C14H21 AB4C14D21 -115.44 1.25 -9.2 -0.12 0
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294006 117421939 1 FNO2C15H22 ABC2D15E22 -118.88 1.9 -8.31 0.13 0
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294007 117421950 1 FNO2C15H22 ABC2D15E22 -131.3 3.29 -8.55 0.11 0
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294008 117422032 1 FNO2C15H22 ABC2D15E22 -117.47 2.82 -8.83 -0.08 0
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294009 117422049 1 FNO2C15H22 ABC2D15E22 -129.11 4.05 -8.62 0.08 0
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294010 117422058 1 FNO2C15H22 ABC2D15E22 -108.49 3.04 -8.84 -0.08 0
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294011 117422066 1 FNO2C15H22 ABC2D15E22 -131.81 6.3 -8.55 0.17 0
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294012 117422067 1 FNO2C15H22 ABC2D15E22 -125.58 3.44 -8.68 -0.02 0
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294013 117422083 1 FNO2C15H22 ABC2D15E22 -121.15 3.01 -8.38 0.06 0
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294014 117422084 1 FNO2C15H22 ABC2D15E22 -120.71 2.74 -8.38 0.13 0
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294015 117422088 1 FNO2C15H22 ABC2D15E22 -119.87 3.43 -8.79 0.0 0
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294016 117422089 1 FNO2C15H22 ABC2D15E22 -121.04 4.06 -8.7 0.04 0
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294017 117422090 1 FNO2C15H22 ABC2D15E22 -125.5 4.59 -8.77 0.05 0
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294018 117422370 1 NSO2C14H21 ABC2D14E21 -84.86 5.16 -8.88 0.27 0
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294019 117422383 1 NSO2C14H21 ABC2D14E21 -87.49 6.55 -9.51 -0.44 0
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294020 117422401 1 NSO2C14H21 ABC2D14E21 -71.07 4.13 -8.62 0.01 0
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294021 117422408 1 NS2C14H21 AB2C14D21 8.72 1.36 -8.55 -0.44 0
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294022 117422409 1 NS2C14H21 AB2C14D21 4.29 1.52 -8.4 -0.27 0
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294023 117422642 1 ClFON3H11C12 ABCD3E11F12 -5.78 0.61 -8.77 -1.11 0
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294024 117422677 1 ClO2N3C12H14 AB2C3D12E14 -32.68 2.87 -8.43 -0.3 0
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294025 117422752 1 ClNO3C13H14 ABC3D13E14 -74.49 2.9 -9.43 -0.58 0
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294026 117422830 1 ClNO3C13H14 ABC3D13E14 -89.67 4.09 -9.09 -1.21 0
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294027 117422832 1 ClNO3C13H14 ABC3D13E14 -84.5 4.37 -9.07 -1.15 0
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294028 117422833 1 ClNO3C13H14 ABC3D13E14 -93.58 6.44 -9.19 -0.52 0
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294029 117422836 1 ClNO3C13H14 ABC3D13E14 -95.23 5.09 -9.07 -0.48 0
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294030 117422845 1 ClNO3C13H14 ABC3D13E14 -93.41 3.46 -9.2 -0.59 0
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294031 117422939 1 ClNO2C14H18 ABC2D14E18 -37.25 3.58 -8.8 -0.28 0
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294032 117422945 1 ClNO2C14H18 ABC2D14E18 -29.3 4.29 -8.57 -0.23 0
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294033 117422965 1 ClNO2C14H18 ABC2D14E18 -54.98 3.41 -8.97 -0.28 0
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294034 117423036 1 ClNO2C14H18 ABC2D14E18 -72.6 3.26 -8.78 -0.33 0
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294035 117423210 1 ClNO2C14H18 ABC2D14E18 -31.79 6.04 -8.48 -0.26 0
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294036 117423231 1 ClNO2C14H18 ABC2D14E18 -68.78 2.57 -8.95 -0.42 0
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294037 117423591 1 ClNSC14H18 ABCD14E18 21.0 2.68 -8.52 -0.26 0
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294038 117423637 1 BrNF3C9H9 ABC3D9E9 -120.6 2.59 -9.65 -0.97 0
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294039 117424269 1 FO4C14H17 AB4C14D17 -199.85 6.96 -9.01 -0.4 0
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294040 117424431 1 O5C14H20 A5B14C20 -203.61 5.0 -8.5 -0.17 0
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294041 117424523 2 NOC8H8 ABC8D8 -42.15 3.05 -8.82 -0.73 0
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294042 117424538 1 ON4C15H16 AB4C15D16 51.93 4.53 -8.23 -0.38 0
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294043 117424815 1 SO3C14H20 AB3C14D20 -115.03 3.73 -8.36 0.14 0
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294044 117425014 1 ClN2O4H9C11 AB2C4D9E11 -65.18 10.4 -7.93 -1.21 0
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294045 117425022 1 ClN2O4H9C11 AB2C4D9E11 -83.9 4.4 -8.44 -2.02 0
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294046 117425174 1 ClSF2O2C10H11 ABC2D2E10F11 -191.31 4.12 -10.05 -1.37 0
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294047 117425230 1 ClN2O3C12H13 AB2C3D12E13 -43.29 3.84 -8.7 -0.62 0
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294048 117425329 1 ClO3C14H17 AB3C14D17 -118.74 3.37 -9.55 -0.56 0
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294049 117425370 1 ClO3C14H17 AB3C14D17 -154.32 5.89 -9.24 -0.41 0