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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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166367 74677930 1 SO4N6C22H30 AB4C6D22E30 -161.91 7.86 -8.97 -1.22 1
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166368 74678338 1 ClN2O3C20H24 AB2C3D20E24 -81.8 3.75 0.0 0.0 -1
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166369 74678436 1 S2O4N5C20H22 A2B4C5D20E22 13.9 7.42 0.0 0.0 0
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166370 74678437 1 SN2O5C19H24 AB2C5D19E24 -140.77 6.23 -9.56 -0.97 -1
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166371 74678438 1 N5O5C16H18 A5B5C16D18 -44.85 3.99 0.0 0.0 0
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166372 74678650 1 F2N4O5C24H34 A2B4C5D24E34 -322.08 9.12 -8.78 -0.29 0
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166373 74678888 1 SO2N5C19H27 AB2C5D19E27 -20.78 2.25 -8.68 -0.14 0
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166374 74678889 1 SO2N5C21H25 AB2C5D21E25 3.96 4.23 -8.64 -0.57 1
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166375 74679882 1 O2S2N4C23H23 A2B2C4D23E23 42.63 11.78 0.0 0.0 1
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166376 74679883 1 O2S2N4H25C28 A2B2C4D25E28 74.82 8.27 0.0 0.0 1
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166377 74679892 1 S2N4O4H21C23 A2B4C4D21E23 -19.94 7.76 0.0 0.0 1
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166378 74679983 1 S2N4O4C25H25 A2B4C4D25E25 -36.54 5.39 0.0 0.0 1
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166379 74679984 1 O4N5C23H28 A4B5C23D28 -84.91 4.67 0.0 0.0 1
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166380 74679985 1 S2N4O4C24H25 A2B4C4D24E25 -45.9 7.58 0.0 0.0 0
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166381 74679986 1 O4N5C18H25 A4B5C18D25 -121.86 3.6 -8.66 -0.19 2
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166382 74680469 1 ClO2N6C17H27 AB2C6D17E27 47.44 28.69 -4.65 -1.5 1
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166383 74681261 1 FSO2N4C23H24 ABC2D4E23F24 -24.78 3.89 0.0 0.0 2
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166384 74681524 1 N2C5H12 A2B5C12 13.35 2.33 -9.24 2.46 -1
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166385 74681525 1 O3F6H7C10 A3B6C7D10 -394.84 6.28 0.0 0.0 0
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166386 74681526 1 O3F6H8C10 A3B6C8D10 -419.76 7.62 -10.65 -1.15 1
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166387 74681527 1 NO2C11H16 AB2C11D16 -36.84 4.57 0.0 0.0 1
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166388 74682052 1 SO2N4C18H25 AB2C4D18E25 -46.77 15.7 0.0 0.0 0
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166389 74682786 1 BrClO2N4F6H16C21 ABC2D4E6F16G21 -322.0 2.41 -9.36 -0.78 0
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166390 74682787 1 BrClON4F6H16C21 ABCD4E6F16G21 -280.1 3.49 -9.55 -0.99 0
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166391 74682788 1 ClSF3O3N4C26H26 ABC3D3E4F26G26 -217.76 3.77 -8.57 -1.43 0