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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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410405 135083200 1 AuN2F5H20C32 AB2C5D20E32 42.29 2.75 -9.04 -1.63 0
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410406 135083201 1 AuClPF5H22C31 ABCD5E22F31 32.16 9.59 -8.69 -3.36 0
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410407 135083202 1 AuBrNF3C22H38 ABCD3E22F38 -148.79 15.68 -8.48 -1.01 0
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410408 135083203 1 AuSN2P2F3H32C43 ABC2D2E3F32G43 187.85 16.92 -8.04 -2.58 0
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410409 135083204 1 SN2P2H30C37 AB2C2D30E37 152.84 13.01 -8.12 -0.47 0
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410410 135083205 1 AuClPN3O6H24C31 ABCD3E6F24G31 135.46 5.5 -9.25 -2.2 0
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410411 135083206 1 AuP2C11H23 AB2C11D23 97.07 3.95 -8.66 -1.75 -4
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410412 135083207 2 AuClC6H14 ABC6D14 185.58 7.56 -6.23 -4.12 0
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410413 135083208 1 AuPC12H20 ABC12D20 0.71 9.39 -8.11 1.08 0
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410414 135083209 1 AuPO2C24H24 ABC2D24E24 130.78 10.65 -8.22 -3.77 0
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410415 135083211 1 AsAuClSO4C23H25 ABCDE4F23G25 111.32 16.96 -8.78 -1.53 0
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410416 135083212 1 AsClO4H18C19 ABC4D18E19 103.78 11.08 -9.98 -2.69 0
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410418 135083214 2 ClH2N2Se2C4 AB2C2D2E4 183.16 0.45 -8.66 -2.6 0
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410419 135083215 1 ClSe2N3H4C8 AB2C3D4E8 136.62 2.17 -8.88 -2.72 0
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410420 135083216 1 NO4C15H17 AB4C15D17 -179.06 6.5 -8.98 -0.09 0
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410421 135083217 1 NSO6H11C16 ABC6D11E16 -181.62 6.9 -10.36 -1.56 0
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410422 135083218 1 BGeC15H27 ABC15D27 15.84 1.0 -8.94 0.57 0
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410423 135083219 1 BGeC20H29 ABC20D29 43.96 0.86 -8.93 0.25 0
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410424 135083220 1 BSnC14H25 ABC14D25 42.9 0.35 -9.34 0.34 0
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410425 135083221 1 O5C12H14 A5B12C14 -187.94 4.84 -10.1 -0.61 0
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410426 135083222 2 OC4H5 AB4C5 -54.31 3.3 -10.07 -0.49 0
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410427 135083223 1 O3C15H22 A3B15C22 -143.16 3.1 -9.4 0.34 0
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410428 135083224 2 NO3C6H8 AB3C6D8 -187.42 4.25 -10.04 -1.11 0
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410429 135083225 2 NO6C7H12 AB6C7D12 -442.74 1.22 -10.5 -1.15 0
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410430 135083226 2 NO6C10H14 AB6C10D14 -420.44 1.62 -9.83 -1.01 0