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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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394358 135022835 1 O3C12H22 A3B12C22 -173.62 1.84 -10.03 0.84 0
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394359 135022836 1 SiO3C24H46 AB3C24D46 -236.43 5.71 -8.61 0.26 0
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394360 135022837 1 O5C24H40 A5B24C40 -242.63 6.65 -10.02 -0.01 0
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394361 135022839 1 SO9C55H60 AB9C55D60 -238.94 5.2 -8.52 0.01 0
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394362 135022840 1 SO9C55H60 AB9C55D60 -224.01 4.7 -8.55 0.02 0
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394363 135022842 1 NO3F5C19H20 AB3C5D19E20 -349.0 6.64 -9.44 -1.15 0
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394364 135022843 1 N2O5H22C25 A2B5C22D25 -55.67 8.86 -9.31 -1.4 0
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394365 135022844 2 OC8H9 AB8C9 -38.41 3.77 -9.38 0.0 -5
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394367 135022852 1 INC13H14 ABC13D14 55.12 0.96 -8.65 -0.84 0
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394368 135022855 1 O5C15H18 A5B15C18 -193.16 3.34 -9.56 0.03 0
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394369 135022861 1 S2O3N8H18C19 A2B3C8D18E19 33.44 3.86 -8.93 -1.22 0
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394370 135022865 1 N6O8C35H42 A6B8C35D42 -234.65 8.55 -8.85 -0.48 0
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394371 135022866 1 O5C24H40 A5B24C40 -261.24 3.31 -9.62 -0.53 0
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394372 135022870 1 O4C27H28 A4B27C28 -71.45 1.03 -9.11 0.24 0
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394373 135022881 1 N4H14C17 A4B14C17 112.91 4.72 -9.03 -0.62 0
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394374 135022882 1 BrO2H19C21 AB2C19D21 -26.98 2.61 -8.56 -1.23 0
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394375 135022883 1 SiO2C19H38 AB2C19D38 -179.56 2.49 -8.77 0.77 0
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394376 135022884 1 O2Si2C25H52 A2B2C25D52 -248.72 2.5 -8.66 0.88 0
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394377 135022886 1 O2C23H28 A2B23C28 -35.27 1.75 -8.92 0.04 0
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394378 135022887 1 SO3C34H50 AB3C34D50 -150.32 5.79 -8.39 -0.5 0
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394379 135022890 1 OC28H46 AB28C46 -71.4 2.66 -9.28 1.14 0
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394380 135022891 2 OC8H9 AB8C9 -44.7 4.31 -9.51 -0.46 0
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394381 135022892 1 NF3O3C6H8 AB3C3D6E8 -297.53 3.39 -10.83 0.35 0
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394382 135022893 1 BrClNO2H15C16 ABCD2E15F16 -51.3 4.17 -9.39 -0.92 0
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394386 135022897 1 IOC17H18 ABC17D18 26.78 3.59 0.0 0.0 0
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394387 135022898 1 N3O3H25C28 A3B3C25D28 61.54 5.57 -8.36 -0.31 0
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394388 135022899 2 NOC7H8 ABC7D8 -26.76 5.61 -8.54 -0.45 0
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394389 135022900 1 O3N4C24H26 A3B4C24D26 -43.9 2.5 -8.61 -0.24 0
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394390 135022901 1 SN2O7C25H32 AB2C7D25E32 -288.6 2.96 -9.67 -0.74 0
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394391 135022902 1 SN2O7C26H34 AB2C7D26E34 -291.9 2.44 -9.62 -0.86 0
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394392 135022903 1 SN2O7C27H36 AB2C7D27E36 -294.68 2.76 -9.54 -0.84 0
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394393 135022904 1 SN2O7C27H36 AB2C7D27E36 -295.78 3.08 -9.55 -0.71 0
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394394 135022905 1 SN2O7C27H36 AB2C7D27E36 -304.43 2.15 -9.52 -0.79 0
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394395 135022906 1 SN2O7C26H34 AB2C7D26E34 -292.49 4.0 -9.62 -0.67 0
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394396 135022907 1 SiO3C16H32 AB3C16D32 -194.01 2.75 -8.82 1.06 0
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394397 135022908 1 O7C23H36 A7B23C36 -325.44 4.42 -8.89 0.13 -1
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394398 135022909 1 O14C49H69 A14B49C69 -294.12 5.34 0.0 0.0 0
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394399 135022910 7 O2C7H10 A2B7C10 -355.2 8.65 -9.84 -0.56 0
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394400 135022911 1 ClNO3H18C19 ABC3D18E19 -93.14 3.69 -8.59 -0.14 0
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394401 135022912 1 FNOC21H24 ABCD21E24 -74.83 1.89 -8.13 -0.22 0
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394402 135022913 1 NOC23H27 ABC23D27 -24.02 3.71 -8.23 0.08 0
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394403 135022914 1 OC11H18 AB11C18 -58.47 2.01 -9.28 1.2 0
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394404 135022915 1 ON4H14C19 AB4C14D19 133.24 5.99 -9.99 -0.29 0
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394405 135022918 2 NOCl3C4H4 ABC3D4E4 -78.48 4.04 -10.8 -1.06 0
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394406 135022919 1 NOF3H16C17 ABC3D16E17 -166.8 1.38 -9.64 -0.08 0
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394407 135022920 1 NO6H27C35 AB6C27D35 -52.66 8.3 -9.49 -0.88 0
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394408 135022921 1 NO6H27C35 AB6C27D35 -39.31 5.46 -9.6 -0.82 0
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394409 135022922 1 O11C55H58 A11B55C58 -299.0 2.84 -9.14 -0.07 0
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394410 135022923 1 NOC12H15 ABC12D15 -9.93 2.02 -8.46 0.2 0
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394411 135022925 2 NO5C9H12 AB5C9D12 -395.44 3.02 -10.18 0.31 0