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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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89924 49965403 1 SN3O3H25C26 AB3C3D25E26 -18.42 7.01 -8.3 -1.04 0
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89925 49965406 1 OSCl2N4H20C24 ABC2D4E20F24 24.76 7.36 -8.6 -1.35 0
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89926 49965408 1 ClFOSN4H20C24 ABCDE4F20G24 -6.9 5.67 -8.46 -1.21 0
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89927 49965409 1 OS2N4C14H14 AB2C4D14E14 49.34 7.2 -8.92 -0.81 0
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89928 49965410 1 ClS2N3O4H14C17 AB2C3D4E14F17 -120.39 5.35 -9.0 -1.66 0
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89929 49965411 1 ClS2F3N3O4H11C17 AB2C3D3E4F11G17 -271.91 3.22 -9.09 -1.94 0
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89930 49965412 2 SN2O3H6C8 AB2C3D6E8 -103.18 3.79 -9.18 -1.93 0
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89931 49965413 1 SN3C21H25 AB3C21D25 62.18 5.37 -8.73 -0.82 0
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89932 49965415 1 BrOSN4H23C25 ABCD4E23F25 36.53 6.25 -8.46 -1.25 0
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89933 49965419 1 ClOSN4H23C25 ABCD4E23F25 29.08 5.78 -8.46 -1.2 0
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89934 49965420 1 OS2N4H24C25 AB2C4D24E25 48.16 6.2 -8.51 -1.12 0
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89935 49965431 1 ClSO3N4H25C26 ABC3D4E25F26 -40.69 6.37 -8.0 -1.19 0
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89936 49965441 1 ClFOSN4H20C24 ABCDE4F20G24 -10.55 7.35 -8.55 -1.31 0
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89937 49965450 1 ClSO3N4H17C21 ABC3D4E17F21 -24.95 7.17 -8.52 -1.62 0
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89938 49965456 1 SN3C19H19 AB3C19D19 100.03 5.69 -8.77 -0.85 0
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89939 49965460 1 OF2N2H12C20 AB2C2D12E20 -23.12 4.97 -8.92 -0.85 0
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89940 49965484 1 BrSO2N5H12C17 ABC2D5E12F17 31.82 12.33 -8.99 -1.24 0
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89941 49965496 1 N4O4C19H20 A4B4C19D20 -73.51 7.84 -8.23 -1.33 0
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89942 49965497 1 ClSO3N5H18C24 ABC3D5E18F24 7.45 11.96 -8.93 -1.18 1
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89943 49965528 1 N2O3C15H15 A2B3C15D15 -69.26 2.51 0.0 0.0 0
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89944 49965529 1 F2N2O2S2H8C13 A2B2C2D2E8F13 -98.27 5.14 -8.97 -1.31 0
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89945 49965531 1 Cl2S2N3O3H9C14 A2B2C3D3E9F14 -61.23 4.83 -9.11 -1.49 0
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89946 49965558 1 FNO4H14C18 ABC4D14E18 -134.92 5.97 -9.39 -1.08 0
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89947 49965572 1 N3O4C22H23 A3B4C22D23 -51.13 4.98 -8.51 -1.74 0
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89948 49965574 2 ON2H8C9 AB2C8D9 29.65 4.88 -8.61 -0.5 0