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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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80672 49835837 1 N2O3H16C17 A2B3C16D17 -36.07 2.88 -8.24 -0.5 0
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80673 49835841 3 N2H4C5 A2B4C5 168.56 3.8 -8.6 -0.76 0
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80674 49835844 1 SN3O5C24H31 AB3C5D24E31 -156.0 2.44 -9.07 -1.07 0
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80675 49835848 1 N2C17H18 A2B17C18 67.45 2.2 -8.39 -0.3 0
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80676 49835859 1 BrO2N3C16H16 AB2C3D16E16 -39.25 5.03 -9.09 -0.73 1
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80677 49835860 1 O3N4H9C14 A3B4C9D14 113.22 4.23 0.0 0.0 0
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80678 49835862 1 SN5O6C28H33 AB5C6D28E33 -109.27 9.24 -8.67 -0.68 0
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80679 49835865 1 N2O2H16C17 A2B2C16D17 -6.11 3.04 -8.67 -0.41 0
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80680 49835866 1 FSN3O5C24H28 ABC3D5E24F28 -159.61 7.49 -9.31 -1.04 0
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80681 49835867 1 NSO3H19C20 ABC3D19E20 -79.03 4.95 -9.06 -1.25 0
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80682 49835874 1 N2O2H16C17 A2B2C16D17 -6.26 1.42 -8.49 -0.43 0
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80683 49835875 1 SN4O6C27H32 AB4C6D27E32 -164.71 5.16 -9.38 -1.22 0
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80684 49835876 1 FN2O2H13C16 AB2C2D13E16 -45.19 3.38 -8.73 -0.59 0
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80685 49835879 1 O3N5C22H23 A3B5C22D23 54.74 7.51 -8.78 -1.2 0
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80686 49835884 1 SN3O3H13C15 AB3C3D13E15 -59.11 2.28 -8.4 -0.94 0
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80687 49835887 1 SO5N6C24H34 AB5C6D24E34 -96.78 6.64 -8.77 -0.41 0
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80688 49835889 1 FN2O2H13C16 AB2C2D13E16 -44.54 2.84 -8.74 -0.68 0
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80689 49835892 1 BrClH3N3C6 ABC3D3E6 81.4 0.46 -9.72 -1.54 0
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80690 49835895 1 BNO2C14H18 ABC2D14E18 -126.21 7.03 -9.5 -0.32 0
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80692 49835899 1 ClN2O2C8H13 AB2C2D8E13 -68.53 3.37 -9.49 -1.37 0
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80693 49835902 1 NO2C10H11 AB2C10D11 -53.15 2.71 -9.19 -0.88 0
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80694 49835904 1 Cl2N2O3H12C14 A2B2C3D12E14 -53.5 1.28 -9.31 -1.17 0
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80695 49835905 1 BNO3C9H10 ABC3D9E10 -179.36 5.67 -9.65 -0.6 0
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80696 49835906 1 OCl2N2C8H10 AB2C2D8E10 -44.85 3.94 -9.73 -0.85 0
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80697 49835912 1 BrNS2O4H16C20 ABC2D4E16F20 -75.34 8.27 -9.33 -1.81 0