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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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148702 53788371 1 SO3H12C13 AB3C12D13 -77.97 4.0 -8.96 -0.41 0
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148703 53788372 1 ClN3C14H16 AB3C14D16 66.45 3.32 -9.7 -0.68 0
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148704 53788373 1 NO4C14H19 AB4C14D19 -135.87 6.15 -9.74 -0.36 0
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148705 53788374 1 OSCl2H4C6 ABC2D4E6 -35.15 0.8 -9.22 -0.81 0
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148706 53788375 1 ON4C14H22 AB4C14D22 -20.59 4.38 -8.05 0.07 0
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148707 53788376 1 N2F3O3H17C19 A2B3C3D17E19 -202.63 6.06 -8.36 -0.88 0
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148708 53788377 1 PN4O24C46H55 AB4C24D46E55 -1072.65 12.33 -9.35 -1.5 1
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148709 53788378 1 ClN3O3C24H33 AB3C3D24E33 -67.44 4.35 0.0 0.0 0
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148710 53788379 2 O2C12H15 A2B12C15 -133.03 3.43 -8.61 -0.45 0
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148711 53788380 1 ClO2F3C16H22 AB2C3D16E22 -260.68 1.86 -8.75 -0.1 0
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148712 53788381 1 O5C14H14 A5B14C14 -153.6 6.17 -9.1 -1.0 0
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148713 53788382 1 SCl2N2O8H26C32 AB2C2D8E26F32 -212.49 4.13 -9.35 -0.96 0
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148714 53788383 1 SO4C14H24 AB4C14D24 -208.25 2.08 -8.87 0.46 0
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148715 53788384 1 SN2O2C10H14 AB2C2D10E14 -55.13 1.29 -7.81 0.11 1
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148716 53788385 1 ClNO2C14H19 ABC2D14E19 -26.77 5.9 0.0 0.0 0
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148717 53788386 1 O4C23H38 A4B23C38 -225.51 5.52 -9.82 0.86 0
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148718 53788387 1 NCl3O3C20H36 AB3C3D20E36 -207.67 2.27 -10.13 -0.76 0
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148719 53788388 1 ClOSC7H7 ABCD7E7 -13.9 2.04 -9.4 -0.48 0
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148720 53788389 1 N2O6C21H28 A2B6C21D28 -207.69 3.63 -8.12 -0.76 0
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148721 53788390 1 SN2O4C10H20 AB2C4D10E20 -178.81 6.4 -9.77 -0.24 0
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148722 53788391 1 SiC17H18 AB17C18 18.16 1.27 -8.16 -0.8 0
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148723 53788392 1 ClNPSO4C9H11 ABCDE4F9G11 -158.49 6.75 -10.23 -1.34 0
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148724 53788393 1 F3S3O5N10H17C18 A3B3C5D10E17F18 -125.67 7.15 -9.59 -1.27 0
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148725 53788394 2 ClNH4C5 ABC4D5 55.29 5.69 -9.36 -0.9 0
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148726 53788395 1 O3C23H36 A3B23C36 -178.96 2.19 -9.04 0.38 0