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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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159543 57288436 2 SN2O3C6H9 AB2C3D6E9 -239.98 3.17 -8.66 -0.75 0
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159544 57288437 1 NC20H25 AB20C25 47.72 1.49 -8.53 -0.01 0
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159545 57288438 1 FN2O3C19H25 AB2C3D19E25 -199.7 4.41 -9.0 -0.3 0
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159546 57288439 1 ClF2S2N5O6H26C33 AB2C2D5E6F26G33 -135.06 8.99 -9.16 -1.15 0
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159547 57288440 1 O3H26C32 A3B26C32 9.55 2.64 -8.37 -0.64 0
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159548 57288441 1 ON3C12H15 AB3C12D15 14.33 6.32 -9.55 -0.83 0
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159549 57288442 1 SO4C5H10 AB4C5D10 -165.61 4.88 -10.82 0.18 0
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159550 57288444 1 FO5C30H33 AB5C30D33 -209.86 3.51 -9.22 -1.11 0
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159551 57288445 1 O3C18H28 A3B18C28 -149.63 3.44 -9.96 0.35 0
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159552 57288446 1 SN4C25H38 AB4C25D38 20.65 5.29 -8.43 -0.28 0
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159553 57288447 1 ON2C25H36 AB2C25D36 -34.31 1.78 -8.08 0.21 0
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159554 57288448 1 FOC26H39 ABC26D39 -113.81 3.71 -8.56 0.33 0
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159555 57288449 1 NSO4C16H23 ABC4D16E23 -169.77 6.71 -9.53 -0.81 0
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159556 57288450 1 PO3C19H31 AB3C19D31 -158.07 1.71 -9.06 0.04 0
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159557 57288451 1 S2N3O5C7H9 A2B3C5D7E9 -144.81 5.33 -11.06 -2.23 0
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159558 57288452 1 N3O3C17H25 A3B3C17D25 -120.69 5.3 -9.18 -0.13 0
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159559 57288453 1 ClS2N5O6C17H18 AB2C5D6E17F18 -141.18 3.04 -9.43 -1.18 0
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159560 57288454 1 PO3C22H39 AB3C22D39 -231.0 2.59 -9.23 0.23 0
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159561 57288457 1 PO3C16H27 AB3C16D27 -180.99 1.27 -9.56 0.2 -1
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159562 57288459 1 ClNSO3C13H17 ABCD3E13F17 -82.53 3.09 0.0 0.0 0
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159563 57288460 1 ClNSO3C13H18 ABCD3E13F18 -104.85 4.8 -8.87 -0.46 0
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159564 57288463 1 NOC9H11 ABC9D11 -0.09 3.7 -9.34 0.56 0
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159565 57288464 1 NO2C11H11 AB2C11D11 5.12 1.89 -8.32 -0.21 0
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159566 57288465 1 OC2N6H8 AB2C6D8 47.8 2.78 -9.02 0.35 0
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159567 57288466 1 SiO4C15H32 AB4C15D32 -277.45 2.88 -8.73 1.33 0