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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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76977 48425658 1 N2O2C19H22 A2B2C19D22 -51.55 2.87 -9.26 -0.2 0
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76978 48425659 1 N2O3C17H26 A2B3C17D26 -139.31 1.97 -8.8 0.4 0
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76979 48425660 1 Cl2O2N3C15H17 A2B2C3D15E17 -74.66 5.71 -8.93 -0.97 0
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76980 48425661 1 SO2N3C19H25 AB2C3D19E25 -67.4 3.75 -8.68 -0.43 0
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76981 48425662 1 SN4O4C14H22 AB4C4D14E22 -132.78 6.41 -8.98 -0.24 0
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76982 48425663 3 NOC6H7 ABC6D7 -74.35 2.04 -9.4 -0.77 0
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76983 48425665 1 O3N4C16H24 A3B4C16D24 -103.09 4.28 -8.69 -0.36 0
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76984 48425666 1 O3N4C21H24 A3B4C21D24 -56.99 4.85 -8.74 -0.51 0
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76985 48425667 1 SO2N6C12H20 AB2C6D12E20 -5.23 6.26 -9.45 -0.86 0
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76986 48425668 1 O2F3N3C13H16 A2B3C3D13E16 -223.03 6.15 -9.8 -1.49 0
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76987 48425670 1 N3O4C23H33 A3B4C23D33 -176.74 3.94 -9.19 -0.22 0
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76988 48425671 1 O3N5C16H21 A3B5C16D21 -48.1 7.59 -9.85 -1.01 0
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76989 48425672 1 SO2N3C13H19 AB2C3D13E19 -65.64 6.41 -8.84 -0.22 0
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76990 48425673 1 FSO2N3C18H22 ABC2D3E18F22 -106.25 5.33 -8.98 -0.66 0
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76991 48425675 1 BrSO2N3C17H20 ABC2D3E17F20 -42.27 4.29 -9.38 -1.08 0
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76992 48425677 1 O2N4C19H24 A2B4C19D24 -12.18 4.78 -9.04 -0.44 0
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76993 48425679 1 SO3N4C17H22 AB3C4D17E22 -56.45 3.42 -9.11 -0.93 0
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76994 48425681 1 SN2O4C20H30 AB2C4D20E30 -183.61 8.93 -9.37 -0.09 0
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76995 48425682 1 O3N4C14H18 A3B4C14D18 -53.74 7.27 -9.8 -1.12 0
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76996 48425684 1 SN3O4C18H27 AB3C4D18E27 -166.37 5.16 -9.7 -0.87 0
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76997 48425687 1 BrFN2O3C15H20 ABC2D3E15F20 -170.82 3.07 -8.94 -0.53 0
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76998 48425688 1 N3O4C20H29 A3B4C20D29 -169.09 2.55 -9.34 -0.22 0
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76999 48425689 1 SO2N3C14H21 AB2C3D14E21 -69.31 4.32 -8.79 -0.33 0
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77000 48425690 1 SO2N3C19H23 AB2C3D19E23 -40.64 5.02 -9.03 -0.8 0
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77001 48425691 1 ClIN2O2C13H16 ABC2D2E13F16 -66.74 0.86 -9.5 -1.39 0