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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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212920 81062245 1 BrON3C12H22 ABC3D12E22 -23.03 2.95 -9.06 0.23 0
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212921 81062246 1 NOSC14H21 ABCD14E21 -27.39 2.63 -8.25 0.14 0
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212922 81062247 1 BFNO3C12H19 ABCD3E12F19 -229.06 2.73 -9.16 -0.23 0
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212923 81062249 1 BNO4C14H24 ABC4D14E24 -232.44 4.41 -8.94 0.08 0
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212924 81062250 1 FON2C15H21 ABC2D15E21 -35.87 3.24 -9.12 -0.42 0
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212925 81062251 1 NO4C11H19 AB4C11D19 -177.12 4.97 -9.7 0.31 0
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212926 81062252 1 ON2C15H22 AB2C15D22 25.19 1.76 -8.9 -0.21 0
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212927 81062253 1 NO4C10H19 AB4C10D19 -186.41 3.98 -9.62 0.15 0
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212928 81062256 1 NSO4C14H23 ABC4D14E23 -166.31 6.01 -9.55 -0.58 0
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212929 81062259 1 O2N4C11H18 A2B4C11D18 -22.43 5.82 -9.31 0.0 0
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212930 81062265 1 NO4C15H25 AB4C15D25 -149.88 1.87 -8.36 -0.04 0
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212931 81062272 1 SN2O2C15H22 AB2C2D15E22 -31.36 4.94 -9.13 -0.92 0
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212932 81062273 1 BrNSO3C12H18 ABCD3E12F18 -111.58 5.9 -8.6 -0.52 0
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212933 81062281 1 SN2O3C14H20 AB2C3D14E20 -62.65 4.94 -9.49 -1.02 0
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212934 81062287 1 N2O3C15H32 A2B3C15D32 -166.47 2.66 -8.56 0.98 0
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212935 81062306 1 O2N3C9H21 A2B3C9D21 -106.09 5.29 -9.4 1.09 0
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212936 81062314 1 N2O4C11H22 A2B4C11D22 -206.41 6.01 -9.71 0.78 0
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212937 81062337 1 N2S2O5C11H18 A2B2C5D11E18 -175.32 3.41 -9.9 -1.28 0
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212938 81062346 1 NO4C8H15 AB4C8D15 -177.06 5.92 -10.03 -0.47 0
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212939 81062354 1 O2N4C9H16 A2B4C9D16 -47.47 6.63 -9.29 -0.1 0
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212940 81062363 1 NO2C13H27 AB2C13D27 -128.22 0.97 -8.76 2.08 0
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212941 81062364 1 NO3C16H21 AB3C16D21 -78.78 5.54 -9.3 -0.45 0
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212942 81062368 1 SN2O2C14H20 AB2C2D14E20 -28.25 4.7 -9.03 -0.79 0
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212943 81062370 1 BrNSO4C12H18 ABCD4E12F18 -139.46 2.77 -9.41 -0.76 0
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212944 81062373 1 BrNSO3C12H18 ABCD3E12F18 -111.43 4.54 -9.57 -0.86 0