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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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169369 75093392 1 ClOSN3C11H14 ABCD3E11F14 16.82 9.52 -9.85 -0.85 0
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169370 75093669 1 S2O4C33H52 A2B4C33D52 -110.51 5.03 -9.19 -0.86 0
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169371 75093670 1 F3N4O4C27H29 A3B4C4D27E29 -171.2 6.52 -8.52 -0.42 0
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169372 75093925 1 N9O10F17C33H36 A9B10C17D33E36 -1180.64 6.51 -10.2 -0.65 0
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169373 75093995 1 NSiO5C21H31 ABC5D21E31 -261.16 5.51 -8.91 -1.52 0
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169374 75094971 1 NO3C8H13 AB3C8D13 -136.04 5.64 -9.82 -0.48 0
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169375 75096430 1 NO2C16H19 AB2C16D19 -32.31 3.7 -9.68 -0.79 0
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169376 75096761 1 ClF3N4O4H18C20 AB3C4D4E18F20 -269.05 6.43 -9.43 -1.2 0
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169377 75096762 1 F3N4O5C21H21 A3B4C5D21E21 -292.11 8.56 -8.39 -0.97 0
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169378 75096879 1 O3C11H16 A3B11C16 -114.83 2.02 -10.03 -0.78 0
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169379 75096958 2 NOC15H18 ABC15D18 8.27 18.7 -8.21 -1.33 0
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169380 75096959 4 OC9H10 AB9C10 -92.05 12.29 -8.05 -1.1 0
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169381 75097198 1 NC13H15 AB13C15 35.02 2.68 -8.03 0.02 0
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169382 75097733 1 ON2H16C19 AB2C16D19 63.67 4.44 -9.26 -0.44 0
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169383 75097795 1 NO6C19H25 AB6C19D25 -212.44 3.56 -8.97 -1.71 0
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169384 75097914 1 SO2C19H26 AB2C19D26 -27.5 4.69 -8.19 0.08 0
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169385 75097943 1 ClNO9H24C29 ABC9D24E29 -295.02 5.61 -9.85 -1.35 0
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169386 75097944 1 ClNO9H24C29 ABC9D24E29 -290.72 6.51 -9.88 -1.51 0
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169387 75098196 1 BrSN3O4H28C31 ABC3D4E28F31 -10.03 4.17 -8.45 -1.42 -5
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169388 75098285 1 Cl2N6O8H17C22 A2B6C8D17E22 76.76 10.32 0.0 0.0 0
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169389 75098296 1 ClN2O3H17C19 AB2C3D17E19 -67.87 7.48 -8.68 -1.46 0
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169390 75098476 1 ClSN3C15H16 ABC3D15E16 85.2 3.31 -8.87 -0.43 0
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169391 75098477 1 OSN3C12H13 ABC3D12E13 46.47 6.25 -8.86 -1.82 0
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169392 75098506 1 ON4C15H20 AB4C15D20 20.61 4.0 -9.06 -0.85 0
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169393 75098816 1 ClOSN5C32H42 ABCD5E32F42 -25.46 2.09 -8.57 -0.38 0