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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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424230 135121838 1 IN3O3C14H22 AB3C3D14E22 -101.08 10.47 -7.86 -0.71 2
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424231 135121843 2 NOC8H19 ABC8D19 -15.85 2.56 -2.82 -0.1 1
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424232 135121847 1 NO2C9H16 AB2C9D16 -53.17 7.66 0.0 0.0 0
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424233 135121859 1 O3C19H26 A3B19C26 -125.42 3.44 -8.97 -0.25 0
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424236 135121864 1 BrOH17C22 ABC17D22 26.42 5.48 -9.28 -0.92 0
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424237 135121871 1 ClOSN3C14H16 ABCD3E14F16 44.16 7.14 -8.55 -1.0 0
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424238 135121872 1 N4O5C11H14 A4B5C11D14 -140.68 12.43 -9.31 -0.44 0
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424239 135121873 1 N3O4C5H7 A3B4C5D7 -66.12 11.36 -9.2 -1.86 0
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424240 135121874 1 O7C22H28 A7B22C28 -274.64 9.29 -10.14 -0.84 0
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424241 135121875 1 N20O23C91H138 A20B23C91D138 -853.41 29.06 -9.06 -0.62 0
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424243 135121879 1 N3O5C11H17 A3B5C11D17 -79.9 26.87 -8.57 -2.58 0
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424245 135121881 1 O7C20H26 A7B20C26 -264.31 5.79 -10.28 -0.8 0
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424246 135121882 7 OC3H4 AB3C4 -257.16 3.41 -10.07 -0.65 1
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424247 135121883 1 O23C42H47 A23B42C47 -860.01 5.75 0.0 0.0 0
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424249 135121888 1 CoPO17N18C72H101 ABC17D18E72F101 -335.54 13.46 0.0 0.0 0
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424250 135121890 1 ClN3O4C16H22 AB3C4D16E22 -123.76 4.42 -9.55 -1.17 0
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424251 135121897 1 ClNF2O4H10C16 ABC2D4E10F16 -149.55 5.13 -9.17 -1.62 0
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424252 135121915 1 BNO3C16H22 ABC3D16E22 -183.95 1.38 -8.35 0.13 0
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424253 135121925 1 O2N7C14H19 A2B7C14D19 26.91 1.89 -8.66 -1.34 0
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424254 135121926 1 O2H6N6C7 A2B6C6D7 110.78 3.35 -9.31 -1.68 0
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424256 135121943 3 OC10H16 AB10C16 -206.36 4.33 -9.66 0.78 0
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424257 135121945 1 Si3O6C16H36 A3B6C16D36 -428.09 4.58 -9.7 0.46 -2
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424258 135121951 2 N3O4C11H14 A3B4C11D14 -293.32 7.97 -8.81 -0.55 0
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424259 135121957 1 NO5C10H15 AB5C10D15 -199.4 4.77 -9.06 -1.51 0
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424260 135121961 1 OH14C19 AB14C19 54.13 3.75 -7.99 -0.98 0