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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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224351 85341952 1 BrO2N3C15H22 AB2C3D15E22 -51.96 3.99 -8.14 -1.03 0
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224352 85342053 1 NO8C17H19 AB8C17D19 -313.57 3.48 -9.5 -0.63 0
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224353 85342056 1 NO4C22H23 AB4C22D23 -85.59 2.94 -9.51 -0.3 2
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224355 85342072 1 F2N3O4C17H19 A2B3C4D17E19 -233.86 6.44 -8.07 -0.14 0
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224357 85342080 1 NO2C24H33 AB2C24D33 -81.77 2.89 -8.97 0.04 0
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224358 85342092 1 O4C23H28 A4B23C28 -112.71 4.51 -9.36 0.04 0
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224359 85342093 1 SiO4C21H24 AB4C21D24 -104.4 4.64 -9.4 -0.22 0
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224360 85342094 1 SiO3C22H28 AB3C22D28 -147.08 1.97 -9.31 -0.06 0
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224361 85342095 2 O2C11H20 A2B11C20 -249.55 2.11 -9.6 0.87 0
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224362 85342097 1 SiO4C20H36 AB4C20D36 -263.64 2.11 -8.79 1.0 0
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224363 85342099 1 SiO2C23H32 AB2C23D32 -116.79 3.06 -8.8 -0.49 0
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224365 85342113 1 ClN2O7C15H15 AB2C7D15E15 -213.85 1.92 -9.06 -0.62 1
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224367 85342122 1 NSO7C16H21 ABC7D16E21 -292.1 4.42 -10.0 -0.77 0
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224368 85342149 1 O7C19H34 A7B19C34 -363.48 2.73 -9.92 0.75 0
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224369 85342156 1 NPO2H22C23 ABC2D22E23 -22.09 9.82 -8.29 -0.59 0
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224370 85342170 1 SN2O3C20H28 AB2C3D20E28 -109.06 8.08 -8.79 -0.6 0
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224371 85342187 1 OCl2N4C18H20 AB2C4D18E20 7.77 6.74 -8.66 -0.51 0
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224372 85342188 1 PN5O7C12H18 AB5C7D12E18 -295.95 7.72 -9.78 -1.05 0
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224374 85342192 1 N3O4C21H21 A3B4C21D21 -78.09 1.21 -8.55 -0.92 0
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224375 85342199 1 O8C19H24 A8B19C24 -350.24 3.31 -8.75 0.3 0
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224376 85342251 1 NO6C21H23 AB6C21D23 -186.59 4.13 -9.37 -1.03 0
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224377 85342252 1 NO5C22H27 AB5C22D27 -107.67 4.44 -8.99 -0.6 0
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224378 85342273 2 ClNOH8C10 ABCD8E10 -12.16 9.33 -9.22 -1.17 0
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224379 85342281 2 NO3C10H12 AB3C10D12 -256.05 3.75 -9.07 0.24 0
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224380 85342283 1 O5C23H32 A5B23C32 -215.03 5.27 -8.67 -0.46 0