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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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70002 47206613 1 NSF3O3C11H12 ABC3D3E11F12 -273.13 3.92 -9.94 -0.53 0
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70003 47206622 1 SN2O3C12H14 AB2C3D12E14 -52.28 5.08 -9.26 -0.62 0
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70004 47206623 1 SN3O4C10H13 AB3C4D10E13 -63.79 6.29 -9.91 -0.79 0
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70005 47206625 1 ClFNSO3C13H15 ABCDE3F13G15 -151.16 5.4 -9.63 -0.42 0
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70006 47206631 1 SN2O4C12H20 AB2C4D12E20 -155.79 3.32 -9.89 -0.01 0
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70007 47206636 1 ClFNSO3C13H17 ABCDE3F13G17 -190.99 2.02 -9.84 -0.6 0
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70008 47206637 1 ClFNSO3C13H17 ABCDE3F13G17 -187.16 4.13 -9.66 -0.46 0
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70009 47206672 1 SN2O3C11H12 AB2C3D11E12 -38.81 6.35 -9.98 -0.41 0
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70010 47206674 1 NSO3C13H17 ABC3D13E17 -95.59 1.65 -9.64 -0.06 0
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70011 47206685 1 BrNSO3C13H18 ABCD3E13F18 -132.6 3.62 -9.59 -0.38 0
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70012 47206694 1 ClNSO4C13H18 ABCD4E13F18 -169.76 2.29 -9.54 -0.23 0
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70013 47206697 1 ClNSO3C11H14 ABCD3E11F14 -122.48 2.52 -9.74 -0.42 0
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70014 47206714 1 BrNSO3C14H18 ABCD3E14F18 -104.58 4.37 -9.53 -0.34 0
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70015 47206725 1 NSCl2O3C10H11 ABC2D3E10F11 -131.33 1.21 -9.72 -0.72 0
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70016 47206769 1 FNSO4C13H18 ABCD4E13F18 -209.17 7.59 -9.58 -0.06 0
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70017 47206785 1 SN3O4C9H11 AB3C4D9E11 -53.66 4.37 -10.51 -0.65 0
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70018 47206806 1 ClNS2O3C9H12 ABC2D3E9F12 -110.43 5.73 -9.24 -0.43 0
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70019 47206829 1 N2O3S3C10H10 A2B3C3D10E10 -69.78 4.46 -9.22 -1.35 0
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70020 47206834 1 SO3N5C11H21 AB3C5D11E21 -94.92 1.5 -10.31 -0.47 0
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70021 47206847 1 NO2S2C14H17 AB2C2D14E17 -50.92 7.39 -9.22 -1.06 0
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70022 47206849 1 NS2O3C13H15 AB2C3D13E15 -78.28 8.19 -8.95 -0.95 0
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70023 47206853 1 SO3N6C10H16 AB3C6D10E16 -4.29 6.08 -11.07 -0.76 0
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70024 47206860 1 SO3N5C11H21 AB3C5D11E21 -84.75 5.52 -9.91 -0.81 0
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70025 47206863 1 SO3N5C11H21 AB3C5D11E21 -87.74 11.81 -10.6 -0.28 0
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70026 47206891 1 SO3N6C9H12 AB3C6D9E12 28.39 3.95 -10.87 -0.75 0