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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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293400 117387110 1 ClO2N3C11H12 AB2C3D11E12 -37.01 3.47 -8.67 -0.44 0
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293401 117387230 1 ClNO2C13H16 ABC2D13E16 -59.26 1.78 -8.79 -0.26 0
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293402 117387237 1 ClNO2C13H16 ABC2D13E16 -58.95 4.83 -9.01 -0.18 0
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293403 117387239 1 ClNO2C13H16 ABC2D13E16 -63.31 3.4 -8.85 -0.17 0
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293404 117387240 1 ClNO2C13H16 ABC2D13E16 -57.74 2.8 -8.86 -0.39 0
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293405 117387302 1 ClNO2C13H16 ABC2D13E16 -67.29 5.5 -9.25 0.02 0
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293406 117387305 1 ClNO2C13H16 ABC2D13E16 -97.6 5.29 -9.49 -0.22 0
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293407 117387416 1 ClNO2C13H16 ABC2D13E16 -53.79 6.71 -8.65 -0.32 0
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293408 117387523 1 ClNO2C13H16 ABC2D13E16 -66.27 3.17 -8.83 -0.35 0
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293409 117387807 1 ClNOC14H20 ABCD14E20 -66.44 3.8 -8.57 -0.02 0
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293410 117387871 1 ClNOC14H20 ABCD14E20 -39.82 3.0 -9.07 -0.02 0
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293411 117387960 1 ClNOC14H20 ABCD14E20 -44.37 3.73 -8.58 0.0 0
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293412 117387987 1 ClNOC14H20 ABCD14E20 -52.45 2.66 -8.88 0.0 0
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293413 117388037 1 ClNSC13H16 ABCD13E16 45.03 2.95 -8.76 -0.52 0
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293414 117388042 1 ClNSC13H16 ABCD13E16 17.36 4.47 -8.55 -0.31 0
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293415 117388087 1 BrON3H8C9 ABC3D8E9 23.3 3.96 -9.05 -0.47 0
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293416 117388108 1 BrNOC11H12 ABCD11E12 2.11 4.29 -9.42 -0.9 0
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293417 117388239 1 F2N2O3H8C11 A2B2C3D8E11 -129.62 4.67 -8.96 -2.13 0
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293418 117388254 1 O7H10C11 A7B10C11 -268.76 2.16 -10.41 -1.42 0
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293419 117388317 1 F2O3H12C13 A2B3C12D13 -190.92 5.41 -9.66 -1.01 0
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293420 117388318 1 F2O3H12C13 A2B3C12D13 -189.2 5.98 -9.73 -1.01 0
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293421 117388326 1 F2O3H12C13 A2B3C12D13 -185.21 3.76 -9.42 -0.66 0
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293422 117388373 2 O3C6H7 A3B6C7 -232.31 1.73 -8.7 -0.46 0
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293423 117388374 2 O3C6H7 A3B6C7 -231.82 5.02 -8.76 -0.43 0
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293424 117388387 2 O3C6H7 A3B6C7 -223.9 3.52 -8.75 -0.59 0