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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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134236 51666206 1 NO2C10H14 AB2C10D14 -38.02 3.49 0.0 0.0 0
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134237 51666315 1 NO7C27H35 AB7C27D35 -288.62 7.59 -8.68 -0.66 0
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134238 51666464 1 N2O9C24H28 A2B9C24D28 -284.98 8.91 -8.77 -1.25 0
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134239 51666675 1 SO2N5H27C28 AB2C5D27E28 60.41 5.85 -8.57 -0.92 0
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134240 51666676 1 N4O5C14H18 A4B5C14D18 -94.36 11.64 -9.05 -1.05 0
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134241 51666677 1 NO5C29H45 AB5C29D45 -287.81 5.93 -9.39 0.65 0
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134242 51667184 1 NSO5C30H35 ABC5D30E35 -169.05 7.93 -8.05 -0.42 2
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134243 51667313 2 NO2C13H23 AB2C13D23 -169.24 23.96 -6.51 -0.94 0
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134244 51667378 3 NO2C6H7 AB2C6D7 -127.34 10.88 -8.67 -1.5 1
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134245 51668155 1 SO2N6C27H35 AB2C6D27E35 21.0 12.06 0.0 0.0 0
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134246 51668597 1 FON2C25H27 ABC2D25E27 -31.19 2.89 -8.74 -0.54 0
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134247 51668786 1 SO2N3C19H27 AB2C3D19E27 -68.15 4.78 -9.08 -0.77 1
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134248 51668881 1 NO2C14H30 AB2C14D30 -114.14 1.98 0.0 0.0 0
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134249 51669086 1 N2O2S2C19H22 A2B2C2D19E22 -1.94 8.78 -8.43 -0.24 0
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134250 51669087 1 N2O2S2C19H22 A2B2C2D19E22 -3.56 7.26 -8.36 -0.24 -1
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134251 51669365 1 SF2O4C21H25 AB2C4D21E25 -231.07 4.81 0.0 0.0 0
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134252 51669578 1 FNOC8H10 ABCD8E10 -74.12 2.21 -9.8 -0.38 0
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134253 51669691 2 NC3H6 AB3C6 -5.01 1.21 -8.97 2.63 1
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134254 51669800 1 ON2C13H19 AB2C13D19 -25.36 3.48 0.0 0.0 1
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134255 51670011 1 BrNOC13H21 ABCD13E21 -26.42 7.05 0.0 0.0 1
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134256 51670012 1 BrNOC18H23 ABCD18E23 2.73 7.68 0.0 0.0 1
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134257 51670090 1 OSN3C21H26 ABC3D21E26 46.42 3.47 0.0 0.0 0
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134258 51670291 1 ClOF3N3C22H25 ABC3D3E22F25 -170.22 3.96 -8.66 -1.07 -1
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134259 51670292 1 O2S2N3C10H14 A2B2C3D10E14 -11.05 5.47 0.0 0.0 0
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134260 51670488 1 NSO5C23H31 ABC5D23E31 -229.74 5.01 -8.29 -0.43 -2