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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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412297 135085182 1 BrFN2O2C27H32 ABC2D2E27F32 -69.18 17.35 -7.3 -1.35 0
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412298 135085183 1 BrFON2C26H28 ABCD2E26F28 -6.95 13.04 -7.57 -1.68 1
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412299 135085184 1 FON2C26H28 ABC2D26E28 4.73 3.14 0.0 0.0 0
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412300 135085185 1 BrFON2C26H28 ABCD2E26F28 -6.25 14.02 -7.53 -1.68 1
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412301 135085186 1 FON2C26H28 ABC2D26E28 5.58 3.83 0.0 0.0 0
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412302 135085187 1 BrON2C27H31 ABC2D27E31 23.59 16.72 -8.3 -0.95 1
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412303 135085188 1 ON2C27H31 AB2C27D31 41.85 1.78 0.0 0.0 0
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412304 135085189 1 BrN2O2C27H31 AB2C2D27E31 -10.68 13.58 -8.03 -0.75 1
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412305 135085190 1 N2O2C27H31 A2B2C27D31 11.86 2.13 0.0 0.0 6
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412307 135085192 1 AlLiNC12H27 ABCD12E27 -94.52 5.21 -8.51 2.5 -1
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412308 135085193 1 AlNC12H27 ABC12D27 -49.16 5.93 0.0 0.0 0
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412309 135085194 1 NO4C15H23 AB4C15D23 -207.27 1.68 -8.52 -0.34 0
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412310 135085195 1 PO2Si2C10H23 AB2C2D10E23 -274.38 4.1 -7.66 0.68 1
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412311 135085196 1 ClNC8H9 ABC8D9 14.66 3.87 0.0 0.0 0
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412312 135085197 1 SC12H12 AB12C12 79.04 1.66 -8.03 -0.36 0
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412313 135085198 1 AgO2C10H13 AB2C10D13 -35.2 16.89 -8.83 -3.47 0
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412314 135085199 1 O3H14C15 A3B14C15 -51.32 2.21 -9.4 -0.57 0
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412315 135085200 1 NH9C12 AB9C12 117.33 3.53 -9.55 -0.46 0
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412316 135085201 2 SC8H10 AB8C10 39.31 1.3 -8.8 -0.17 0
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412317 135085202 1 ClN2O2H9C12 AB2C2D9E12 37.72 2.5 -10.15 -1.32 0
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412318 135085205 1 AlClN2O2H58C64 ABC2D2E58F64 -31.38 4.41 -7.45 -1.4 1
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412320 135085209 1 AlNSO3F12H24C43 ABCD3E12F24G43 -669.43 3.57 -8.85 -1.6 0
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412321 135085210 1 AlS2N4F6O6C20H29 AB2C4D6E6F20G29 -534.45 8.5 -10.08 -1.77 0
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412322 135085211 2 PdO2F3H10C11 AB2C3D10E11 -332.53 3.31 -7.46 -0.69 0
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412323 135085212 1 FeNOSiC23H42 ABCDE23F42 56.39 4.74 0.0 0.0 0