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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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148752 53788421 1 PSiN5O5C19H36 ABC5D5E19F36 -259.36 1.46 -8.84 -0.5 0
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148753 53788422 1 ON2C6H12 AB2C6D12 -18.33 5.37 -9.2 -0.32 0
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148754 53788423 1 ClSO2N5H24C27 ABC2D5E24F27 54.88 9.04 -9.13 -0.98 0
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148755 53788424 1 NOF4C19H19 ABC4D19E19 -187.75 4.57 -9.85 -0.98 0
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148756 53788425 1 IO3C20H33 AB3C20D33 -137.92 4.25 -9.53 -0.65 0
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148757 53788426 1 ON2C11H12 AB2C11D12 52.82 1.48 -9.36 -0.45 0
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148758 53788427 1 ClNO2H18C19 ABC2D18E19 -53.24 4.74 -9.41 -0.91 0
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148759 53788428 1 ClNSO4C10H10 ABCD4E10F10 -129.29 5.09 -10.39 -1.16 0
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148760 53788429 1 NO3H15C16 AB3C15D16 -73.62 5.19 -9.04 -0.15 0
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148761 53788430 1 O3C21H32 A3B21C32 -141.21 5.29 -8.7 -0.11 0
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148762 53788431 1 NO2C12H19 AB2C12D19 -65.87 2.95 -8.73 0.38 0
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148763 53788432 2 NC4H4 AB4C4 49.92 3.54 -8.26 -0.34 0
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148764 53788433 2 NO2C6H12 AB2C6D12 -193.63 1.51 -9.72 0.91 0
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148765 53788434 1 NSO5C11H21 ABC5D11E21 -240.45 5.59 -9.8 0.47 0
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148766 53788435 1 BSiO3C11H19 ABC3D11E19 -271.74 1.89 -9.1 0.18 2
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148767 53788436 1 Cl2N6O9H22C24 A2B6C9D22E24 -55.76 8.51 -9.44 -2.57 0
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148768 53788437 2 NOC8H8 ABC8D8 -33.24 5.04 -8.53 -0.05 0
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148769 53788438 2 S3C5H7 A3B5C7 57.34 3.39 -8.92 -2.19 0
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148770 53788439 1 NSiO4C34H47 ABC4D34E47 -184.81 2.92 -8.99 -0.76 0
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148771 53788440 1 NSO6C17H33 ABC6D17E33 -317.49 4.27 -10.27 -0.41 0
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148772 53788441 1 SN2O5H12C16 AB2C5D12E16 -131.58 5.44 -9.21 -1.52 0
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148773 53788442 1 SN3O4H19C20 AB3C4D19E20 -92.4 4.23 -9.12 -0.65 0
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148774 53788443 1 SN2O7C27H34 AB2C7D27E34 -212.06 9.82 -8.89 -1.38 0
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148775 53788444 1 SO2N5C18H23 AB2C5D18E23 -17.54 2.81 -8.2 -0.16 0
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148776 53788445 1 ClFON3H13C18 ABCD3E13F18 29.34 6.4 -9.94 -1.36 0