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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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159970 57304230 1 N2S2O3C18H22 A2B2C3D18E22 -57.8 4.27 -8.73 -0.55 0
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159971 57304233 1 S2N4O4H18C25 A2B4C4D18E25 21.47 10.77 -9.17 -1.74 0
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159972 57304235 1 O3H14C17 A3B14C17 -37.42 1.92 -8.74 -0.65 0
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159973 57304239 1 NO5C15H17 AB5C15D17 -187.2 3.19 -8.54 -0.37 0
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159974 57304244 1 N3O6C12H13 A3B6C12D13 -178.47 5.95 -9.61 -0.79 0
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159975 57304250 1 NOSiF7C8H12 ABCD7E8F12 -433.14 5.85 -9.54 0.06 0
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159976 57304256 1 NO3C14H17 AB3C14D17 -98.05 5.88 -8.88 -0.38 0
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159977 57304258 1 ON2C7H14 AB2C7D14 -37.72 2.17 -8.99 0.94 0
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159978 57304264 1 O4N7C36H57 A4B7C36D57 -165.31 0.9 -8.97 -0.56 0
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159979 57304266 1 OC12H14 AB12C14 -11.86 3.85 -9.72 -0.47 0
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159980 57304275 1 OSN5C25H27 ABC5D25E27 60.71 3.78 -8.51 -0.9 0
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159981 57304278 1 NSO4C23H33 ABC4D23E33 -145.43 4.27 -8.09 -0.8 0
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159982 57304279 1 NO4C6H13 AB4C6D13 -194.88 2.13 -10.18 1.91 0
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159983 57304292 1 O6C25H26 A6B25C26 -172.94 3.64 -9.01 -1.25 0
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159984 57304297 1 SO3C17H24 AB3C17D24 -129.51 5.18 -10.16 -0.53 0
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159985 57304301 1 O4C23H32 A4B23C32 -183.31 6.45 -9.92 -0.59 0
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159986 57304322 2 NO4C10H15 AB4C10D15 -354.22 2.89 -9.84 -0.04 0
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159987 57304331 1 NO10C34H35 AB10C34D35 -345.18 2.65 -8.86 -0.81 0
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159988 57304332 1 ClNO2C6H10 ABC2D6E10 -87.44 5.82 -10.09 -0.5 1
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159989 57304335 1 SF3O3N4C8H14 AB3C3D4E8F14 -169.45 6.52 0.0 0.0 0
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159990 57304336 1 Cl2O2N3H7C10 A2B2C3D7E10 -22.81 6.26 -8.85 -1.31 0
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159991 57304340 1 N3O5C12H13 A3B5C12D13 -108.11 8.31 -9.94 -1.48 0
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159992 57304343 4 OC3H6 AB3C6 -177.46 2.11 -9.73 1.31 0
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159993 57304344 1 OCl2N4C24H26 AB2C4D24E26 10.13 7.56 -8.76 -0.64 0
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159994 57304346 1 PSO4C14H21 ABC4D14E21 -216.99 4.99 -8.99 -0.48 0