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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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226228 87350188 1 F2N4O6C23H30 A2B4C6D23E30 -315.91 8.35 -9.29 -1.08 0
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226229 87350189 2 Si2O3C9H21 A2B3C9D21 -551.58 2.61 -9.8 0.38 0
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226230 87350190 2 Si2O3C9H21 A2B3C9D21 -554.58 2.77 -9.68 0.15 0
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226231 87350191 2 Si2O3C9H21 A2B3C9D21 -571.52 3.64 -9.55 0.08 0
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226232 87350195 1 N2O4C15H28 A2B4C15D28 -220.14 1.74 -9.9 -0.68 0
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226233 87350196 1 N2O3C20H40 A2B3C20D40 -224.61 6.7 -10.74 -0.16 0
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226234 87350201 1 ClSN4H13C21 ABC4D13E21 140.48 2.98 -8.51 -1.13 0
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226235 87350202 1 PO3C24H51 AB3C24D51 -303.56 1.54 -10.35 1.18 1
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226236 87350203 1 NPC5O6H13 ABC5D6E13 -290.48 3.76 0.0 0.0 1
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226237 87350204 1 NPC5O6H13 ABC5D6E13 -290.07 6.7 0.0 0.0 1
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226238 87350205 1 NPC5O5H11 ABC5D5E11 -240.93 4.27 0.0 0.0 0
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226239 87350206 1 ON3F6H11C17 AB3C6D11E17 -270.75 7.68 -8.8 -1.67 0
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226240 87350210 1 SF2N5O6C21H27 AB2C5D6E21F27 -258.36 2.84 -9.25 -1.68 0
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226241 87350212 1 N2O5C8H16 A2B5C8D16 -223.05 4.76 -9.8 -0.18 1
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226242 87350213 1 NSO5C17H18 ABC5D17E18 -143.13 0.56 0.0 0.0 0
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226243 87350217 1 FN3O3C32H32 AB3C3D32E32 -89.74 7.59 -8.57 -0.6 0
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226244 87350218 1 FO4N6C57H57 AB4C6D57E57 -20.88 4.47 -8.4 -0.63 0
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226245 87350219 1 SF2N5O6C22H29 AB2C5D6E22F29 -277.66 8.56 -8.35 -0.6 0
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226246 87350220 1 NO2C23H45 AB2C23D45 -135.04 4.14 -8.95 1.23 0
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226247 87350224 1 ClOC16H17 ABC16D17 7.55 4.88 -9.84 -0.87 0
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226248 87350225 1 N6O7C15H26 A6B7C15D26 -332.3 2.42 -10.03 0.12 0
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226249 87350227 1 BrON2H15C21 ABC2D15E21 60.24 2.37 -8.95 -0.97 0
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226250 87350228 1 BrOSN2H19C21 ABCD2E19F21 42.16 5.07 -8.88 -2.0 0
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226251 87350231 1 ON3H27C30 AB3C27D30 46.9 5.79 -8.59 -0.3 0
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226252 87350233 1 OSN2H18C20 ABC2D18E20 43.0 6.17 -8.77 -1.83 0