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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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165341 74534810 1 FO2N7C24H26 AB2C7D24E26 -22.76 8.41 -8.76 -1.03 0
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165342 74534811 1 O3N7C22H25 A3B7C22D25 -4.65 7.94 -8.8 -1.1 0
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165343 74534812 1 SO2N7C22H25 AB2C7D22E25 29.99 8.01 -8.68 -1.34 0
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165344 74534832 1 O3N7C26H31 A3B7C26D31 -21.67 7.36 -8.75 -0.4 0
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165345 74535292 1 O3N6C22H32 A3B6C22D32 -94.47 6.81 -9.4 -0.42 1
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165346 74535587 1 ClFO2N4H21C27 ABC2D4E21F27 22.86 5.44 0.0 0.0 -1
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165347 74535685 1 ClFSN4O5H15C19 ABCD4E5F15G19 -83.51 4.95 0.0 0.0 -1
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165348 74535857 1 FSN2O6C23H24 ABC2D6E23F24 -180.83 2.5 0.0 0.0 -1
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165349 74535999 1 N2O4H17C22 A2B4C17D22 1.13 10.85 0.0 0.0 0
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165350 74536069 1 SO3N4C20H24 AB3C4D20E24 -75.72 7.48 -8.73 -0.65 0
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165351 74536070 1 SO3N4C19H24 AB3C4D19E24 -99.32 5.03 -8.91 -0.6 0
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165352 74536071 2 ON2C9H10 AB2C9D10 1.47 5.52 -8.99 -0.38 0
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165353 74536072 1 SO3N4C19H24 AB3C4D19E24 -99.51 6.92 -8.72 -0.65 0
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165354 74536563 1 SN3O5C19H21 AB3C5D19E21 -105.85 7.91 -9.61 -1.85 0
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165355 74536725 1 S2N3O6C22H25 A2B3C6D22E25 -205.95 4.0 -9.13 -0.62 1
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165356 74536834 1 NO4C12H24 AB4C12D24 -125.58 3.35 0.0 0.0 -1
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165357 74537266 1 OF3N5H13C21 AB3C5D13E21 -36.34 8.72 0.0 0.0 0
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165358 74537337 1 SCl2N2O3H16C20 AB2C2D3E16F20 -53.91 5.48 -9.04 -1.73 0
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165359 74537338 1 SCl2O2N4H16C20 AB2C2D4E16F20 -21.21 3.24 -8.83 -1.7 0
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165360 74537776 1 NSO6C22H25 ABC6D22E25 -230.61 4.54 -9.23 -1.25 -1
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165361 74538602 1 FNO4C23H23 ABC4D23E23 -126.21 10.48 0.0 0.0 0
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165362 74538784 1 OF4N5H13C17 AB4C5D13E17 -136.05 7.27 -9.17 -1.39 0
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165364 74539341 2 NH9C13 AB9C13 145.49 7.33 -7.75 -1.17 -1
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165365 74540186 1 FNO4H15C22 ABC4D15E22 -67.54 6.43 0.0 0.0 2
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165366 74540476 2 NC12H13 AB12C13 88.55 2.46 -6.92 -0.2 0