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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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168357 74957234 1 O2N3C15H21 A2B3C15D21 -23.44 4.43 -8.1 -0.42 0
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168358 74957235 1 O2N3C18H23 A2B3C18D23 -31.27 6.18 -8.68 -0.64 0
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168359 74957236 1 N2O3H12C17 A2B3C12D17 11.47 5.98 -9.27 -1.42 0
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168360 74957237 1 ON4H12C17 AB4C12D17 136.94 7.95 -9.15 -1.84 0
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168361 74957238 1 Cl2N2O3H12C14 A2B2C3D12E14 -42.02 3.61 -8.48 -1.45 0
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168362 74957239 1 O3C22H22 A3B22C22 -70.95 5.16 -9.65 -0.92 0
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168363 74957240 1 ClO2N3H8C15 AB2C3D8E15 29.62 5.07 -8.66 -1.6 0
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168364 74957243 1 ON6H28C30 AB6C28D30 137.07 7.77 -8.43 -1.1 0
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168365 74957246 1 FSCl2N5O5C28H30 ABC2D5E5F28G30 -202.17 5.48 -9.11 -1.28 -4
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168366 74957833 1 CoN11O15C55H68 AB11C15D55E68 -279.31 35.65 -8.46 -4.08 0
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168367 74958001 1 SO4N6C35H50 AB4C6D35E50 -145.66 4.68 -7.94 0.11 0
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168368 74958010 1 ClSN3O4C53H58 ABC3D4E53F58 -36.6 0.46 -8.65 -1.12 0
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168369 74958024 2 FON2C11H15 ABC2D11E15 -141.1 2.89 -9.02 0.06 0
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168370 74958461 1 BrO2N3H12C17 AB2C3D12E17 30.15 5.3 -8.88 -1.67 1
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168373 74959017 1 FN5O5C27H32 AB5C5D27E32 -210.33 4.81 -8.7 -0.77 0
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168374 74959083 1 SCl2N6O6C40H54 AB2C6D6E40F54 -301.84 6.69 -9.49 -0.75 0
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168375 74959794 1 N2O2H16C17 A2B2C16D17 -15.63 2.73 -9.62 -0.4 0
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168376 74959795 1 O2N5H13C16 A2B5C13D16 124.45 13.86 -8.94 -1.96 0
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168377 74959796 1 NO4H17C19 AB4C17D19 -70.11 3.28 -9.74 -0.22 0
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168378 74959797 2 N2O3H16C17 A2B3C16D17 -91.61 7.63 -9.35 -1.1 0
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168379 74959798 2 N2O2C6H7 A2B2C6D7 -90.43 5.37 -8.97 -1.23 0
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168380 74959799 1 SO4C22H30 AB4C22D30 -148.38 4.36 -8.61 0.14 1
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168381 74959822 1 NC25H32 AB25C32 58.12 2.83 0.0 0.0 0
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168382 74959823 2 O2C15H25 A2B15C25 -254.47 3.54 -9.26 0.43 0
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168383 74959824 5 OC6H10 AB6C10 -301.89 4.9 -9.39 0.62 0