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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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149252 53788924 1 N3O8C12H21 A3B8C12D21 -265.01 1.28 -10.22 -0.62 0
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149253 53788925 1 OSN5C15H17 ABC5D15E17 33.09 6.48 -8.75 -0.84 0
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149254 53788926 2 ON2C6H11 AB2C6D11 -95.62 7.02 -9.52 0.31 0
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149255 53788927 1 O3C20H26 A3B20C26 -129.45 3.64 -9.34 0.33 0
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149256 53788928 1 ClSO2N8C25H27 ABC2D8E25F27 86.52 9.4 -8.7 -1.33 0
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149257 53788929 1 NOC6H7 ABC6D7 -0.28 2.08 -9.91 -1.0 0
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149258 53788930 1 SN2O6C32H40 AB2C6D32E40 -173.75 7.26 -8.21 -0.43 0
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149259 53788931 1 OSN2C12H16 ABC2D12E16 -29.1 5.19 -8.56 -0.05 0
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149260 53788932 1 NOC11H17 ABC11D17 -20.95 5.33 -9.65 -0.77 0
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149261 53788933 2 NC11H16 AB11C16 11.85 2.55 -9.07 0.19 0
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149262 53788934 2 O3H7C9 A3B7C9 -201.88 6.7 -10.34 -1.46 0
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149263 53788935 1 SO4C17H24 AB4C17D24 -146.36 3.77 -8.26 0.04 0
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149264 53788936 3 NO2H7C10 AB2C7D10 60.31 8.08 -8.84 -1.75 0
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149265 53788937 1 NF2O2H9C11 AB2C2D9E11 -149.44 3.76 -9.83 -1.21 0
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149266 53788938 1 O3C39H76 A3B39C76 -207.32 9.37 -6.86 -0.88 1
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149267 53788939 1 N3O3C20H20 A3B3C20D20 -24.17 3.09 0.0 0.0 0
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149268 53788940 1 N2O5C12H16 A2B5C12D16 -203.36 3.63 -8.67 -0.56 0
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149269 53788941 1 O2N3H17C22 A2B3C17D22 42.53 4.63 -8.3 -1.07 0
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149270 53788942 1 N2F3O7C15H17 A2B3C7D15E17 -354.99 11.32 -9.45 -1.52 0
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149271 53788943 1 SO8C23H44 AB8C23D44 -427.6 4.13 -10.68 -0.73 0
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149272 53788944 1 SN3O3C17H19 AB3C3D17E19 -30.18 1.48 -8.32 -0.55 0
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149273 53788945 1 NO3C4H7 AB3C4D7 -29.24 4.12 -10.42 -0.97 0
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149274 53788946 1 NOC23H27 ABC23D27 13.18 2.84 -8.78 -0.67 0
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149275 53788947 1 FO3N4C24H29 AB3C4D24E29 -41.34 3.34 -8.7 -0.85 0
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149276 53788948 1 O3N6C21H28 A3B6C21D28 -54.2 3.75 -8.51 -0.17 0