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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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171228 75346497 1 BrNSO4H26C31 ABCD4E26F31 -63.95 4.67 -8.59 -1.07 0
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171229 75346498 1 ClSN2O3H25C26 ABC2D3E25F26 -73.82 7.23 -8.41 -1.01 0
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171230 75346499 1 NS2O6H27C31 AB2C6D27E31 -156.0 6.21 -8.45 -1.04 0
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171231 75347132 1 INSO6H28C30 ABCD6E28F30 -146.64 5.21 -8.57 -1.31 0
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171232 75347171 1 ClFNSO5C31H31 ABCDE5F31G31 -192.92 3.3 -8.68 -1.48 0
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171233 75347172 1 SN2O8H28C30 AB2C8D28E30 -169.36 6.05 -8.63 -1.77 0
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171234 75347173 1 BrClNSO5C31H31 ABCDE5F31G31 -145.21 1.97 -8.72 -1.23 0
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171235 75347229 1 SN2O7C33H36 AB2C7D33E36 -214.99 3.07 -8.56 -1.62 0
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171236 75347350 1 ClSN2O5C29H29 ABC2D5E29F29 -161.08 4.8 -8.55 -1.64 0
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171237 75347775 1 NSO5H25C30 ABC5D25E30 -89.23 2.04 -8.5 -1.23 0
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171238 75348255 1 SN2O6C22H22 AB2C6D22E22 -133.85 1.97 -8.68 -1.88 0
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171239 75348436 1 BrSN2O3H23C28 ABC2D3E23F28 -26.62 8.03 -8.37 -1.19 0
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171240 75348487 1 BrClNSO6H21C30 ABCDE6F21G30 -125.73 2.36 -8.58 -1.71 0
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171241 75348505 1 BrClNSO6H23C31 ABCDE6F23G31 -135.53 1.79 -8.54 -1.75 0
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171242 75348526 1 NSCl2O4H19C24 ABC2D4E19F24 -98.26 4.12 -8.55 -1.79 0
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171243 75348716 1 NSCl2O4H19C24 ABC2D4E19F24 -98.77 3.28 -8.57 -1.8 0
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171244 75349193 1 NSO4H25C30 ABC4D25E30 -59.35 5.68 -8.44 -1.36 0
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171245 75349194 1 ClSN3O4H20C28 ABC3D4E20F28 -11.15 6.13 -8.67 -2.17 0
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171246 75349368 1 ClNSO8H16C24 ABCD8E16F24 -235.06 5.41 -9.07 -2.25 0
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171247 75349369 1 ClFNSO6H19C26 ABCDE6F19G26 -196.29 5.27 -8.92 -1.66 0
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171248 75349370 1 ClNSO5H18C25 ABCD5E18F25 -112.58 7.44 -8.9 -1.55 0
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171249 75349371 1 ClNSO4H22C29 ABCD4E22F29 -59.79 7.41 -8.88 -1.42 0
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171250 75349372 1 ClNSO5H24C30 ABCD5E24F30 -93.42 7.24 -8.83 -1.3 0
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171251 75349838 1 ClNSO7H24C27 ABCD7E24F27 -209.25 2.27 -8.64 -1.54 0
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171252 75349887 1 NSO6H23C30 ABC6D23E30 -119.71 2.47 -8.88 -1.48 0
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171253 75349888 1 SN3O7H21C28 AB3C7D21E28 -71.91 5.54 -8.6 -1.91 0
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171254 75349889 1 FINSO5H25C31 ABCDE5F25G31 -120.9 4.17 -8.51 -1.67 0
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171255 75349890 1 ClNSO4H22C29 ABCD4E22F29 -59.54 4.41 -8.43 -1.22 0
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171256 75350235 1 NSCl2O6H23C28 ABC2D6E23F28 -171.1 3.56 -8.63 -1.62 0
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171257 75350749 1 NSI2O4H19C21 ABC2D4E19F21 -70.0 4.25 -8.59 -1.48 0
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171258 75350750 1 ClNSO5C22H22 ABCD5E22F22 -152.28 3.05 -8.68 -1.57 0
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171259 75350751 1 BrClNSO6H15C20 ABCDE6F15G20 -178.7 1.24 -9.03 -1.84 0
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171260 75350752 1 ClNSO3H16C19 ABCD3E16F19 -70.76 3.75 -8.61 -1.44 0
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171261 75350863 1 NSO4H19C20 ABC4D19E20 -102.63 3.99 -8.62 -1.36 0
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171262 75350934 1 IN2S2O9H21C26 AB2C2D9E21F26 -166.55 4.1 -8.67 -2.17 0
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171263 75350935 1 SN2O6H18C20 AB2C6D18E20 -110.32 5.29 -8.65 -1.77 0
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171264 75350936 1 FNSO5H20C26 ABCD5E20F26 -162.8 4.25 -8.63 -1.45 0
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171265 75350937 1 NSO5H27C28 ABC5D27E28 -119.56 5.0 -8.59 -1.31 0
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171266 75350938 1 ClNSO5H26C31 ABCD5E26F31 -99.8 5.13 -8.64 -1.52 0
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171267 75350939 1 BrClSN2O5H22C27 ABCD2E5F22G27 -120.44 3.65 -8.64 -1.55 0
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171268 75350940 1 NSO5H29C32 ABC5D29E32 -103.21 2.86 -8.63 -1.39 0
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171269 75350941 1 SN2O3H16C20 AB2C3D16E20 -31.03 3.29 -8.72 -1.68 0
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171270 75350949 1 BrNSO4H18C23 ABCD4E18F23 -61.11 4.47 -8.68 -1.73 0
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171271 75351820 1 BrNSO6H18C20 ABCD6E18F20 -167.51 3.19 -8.46 -1.37 0
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171272 75351821 1 BrNSO6C22H22 ABCD6E22F22 -164.9 6.73 -8.39 -1.25 0
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171273 75351922 1 NSO7H19C21 ABC7D19E21 -209.01 3.27 -8.54 -1.48 0
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171274 75351923 1 NSBr2O5H19C21 ABC2D5E19F21 -123.28 6.16 -8.4 -1.7 0
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171275 75352203 1 SN2O4C24H24 AB2C4D24E24 -93.86 8.32 -8.34 -1.2 0
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171276 75352429 1 SN2O8H24C27 AB2C8D24E27 -141.3 10.02 -8.48 -1.63 -1
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171277 75352897 1 ClS2O4N6C20H26 AB2C4D6E20F26 -87.1 5.12 0.0 0.0 0