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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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41778 8147102 1 SN3O3C23H27 AB3C3D23E27 -72.22 4.97 -8.23 -0.83 0
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41779 8147103 2 NOC11H11 ABC11D11 -3.4 7.32 -8.96 -0.51 0
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41780 8147105 1 O5C20H22 A5B20C22 -143.3 2.9 -8.43 -0.72 0
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41781 8147106 1 ClN2O3C14H15 AB2C3D14E15 -64.69 6.09 -8.55 -0.51 1
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41782 8147107 1 ClN3O3C22H25 AB3C3D22E25 -58.5 10.0 0.0 0.0 0
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41783 8147108 1 ClN3O3C22H24 AB3C3D22E24 -75.65 6.7 -8.32 -0.83 0
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41784 8147109 1 N2S2O3C16H16 A2B2C3D16E16 -71.33 4.26 -8.92 -0.96 0
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41785 8147110 1 SN3O3C17H17 AB3C3D17E17 -55.42 2.39 -8.89 -1.12 0
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41786 8147111 1 SN3O5C17H19 AB3C5D17E19 -83.57 7.13 -9.27 -1.77 1
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41787 8147112 1 N3O3C23H28 A3B3C23D28 -51.58 10.67 0.0 0.0 1
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41788 8147114 1 N3O3C23H28 A3B3C23D28 -51.88 10.75 0.0 0.0 0
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41789 8147115 1 N3O3C23H27 A3B3C23D27 -72.32 3.26 -8.35 -0.58 0
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41790 8147116 1 N2O2S2H16C17 A2B2C2D16E17 8.79 2.91 -8.98 -1.24 0
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41791 8147117 2 NOSC10H10 ABCD10E10 -2.41 1.38 -8.85 -0.76 1
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41792 8147118 1 O2N5C24H24 A2B5C24D24 68.77 6.97 0.0 0.0 0
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41793 8147119 1 O2N5H23C24 A2B5C23D24 53.82 7.92 -8.9 -0.84 0
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41794 8147120 1 NO4H19C24 AB4C19D24 -80.25 5.54 -9.18 -0.84 0
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41795 8147121 1 ClSO2N3H18C19 ABC2D3E18F19 -44.2 3.75 -8.88 -0.76 1
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41796 8147122 1 SO3N5C20H26 AB3C5D20E26 -44.79 8.33 0.0 0.0 0
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41797 8147123 1 SO3N5C20H25 AB3C5D20E25 -57.59 10.18 -9.2 -0.6 0
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41798 8147124 1 OSCl2N3H9C14 ABC2D3E9F14 23.81 2.66 -9.04 -1.56 0
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41799 8147125 1 SF2O2N3H15C19 AB2C2D3E15F19 -105.11 3.8 -8.89 -1.2 1
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41800 8147126 1 SO3N5C20H26 AB3C5D20E26 -42.44 10.68 0.0 0.0 0
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41801 8147127 1 SO3N5C20H25 AB3C5D20E25 -58.07 9.59 -9.16 -0.56 0
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41802 8147128 1 SF2O2N3H15C19 AB2C2D3E15F19 -110.53 4.62 -8.49 -1.49 0