Chem
J-GLOBAL ID：201607003855833250   Nikkaji number：J3.526.108G

2,6,10-Tri(4-pyridyl)-4,8,12-trioctyl-4,8,12-triaza-8,12c-dihydro-4H,12H-dibenzo[cd,mn]pyrene-12c-cation

2,6,10-トリ(4-ピリジル)-4,8,12-トリオクチル-4,8,12-トリアザ-8,12c-ジヒドロ-4H,12H-ジベンゾ[cd,mn]ピレン-12c-カチオン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C57[C+]H69N6
Molecular formula furigana： C58-H69-N6
Molecular weight： 850.231
InChI： InChI=1S/C58H69N6/c1-4-7-10-13-16-19-34-62-49-37-46(43-22-28-59-29-23-43)39-51-55(49)58-56-50(62)38-47(44-24-30-60-31-25-44)40-52(56)64(36-21-18-15-12-9-6-3)54-42-48(45-26-32-61-33-27-45)41-53(57(54)58)63(51)35-20-17-14-11-8-5-2/h22-33,37-42H,4-21,34-36H2,1-3H3/q+1
InChI key： RFFFUEDRWHSQOE-UHFFFAOYSA-N
SMILES： CCCCCCCCn1c2cc(cc3n(CCCCCCCC)c4cc(cc5n(CCCCCCCC)c6cc(cc1c6[C+](c23)c45)c1ccncc1)c1ccncc1)c1ccncc1
Systematic name  (1)：
  • 2,6,10-トリ(4-ピリジル)-4,8,12-トリオクチル-4,8,12-トリアザ-8,12c-ジヒドロ-4H,12H-ジベンゾ[cd,mn]ピレン-12c-カチオン
Other name (1)：
  • 2,6,10-Tri(4-pyridyl)-4,8,12-trioctyl-4,8,12-triaza-8,12c-dihydro-4H,12H-dibenzo[cd,mn]pyrene-12c-cation
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