Chem
J-GLOBAL ID：201507011083131780   Nikkaji number：J3.409.576K

2,2′-(1,4-Phenylene)bis(5,8-di(4-pyridyl)-1H-perimidine)

2,2′-(1,4-フェニレン)ビス(5,8-ジ(4-ピリジル)-1H-ペリミジン)
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： C48H30N8
Molecular formula furigana： C48-H30-N8
Molecular weight： 718.824
InChI： InChI=1S/C48H30N8/c1-2-34(48-55-43-27-37(31-9-17-51-18-10-31)23-40-24-38(28-44(56-48)46(40)43)32-11-19-52-20-12-32)4-3-33(1)47-53-41-25-35(29-5-13-49-14-6-29)21-39-22-36(26-42(54-47)45(39)41)30-7-15-50-16-8-30/h1-28H,(H,53,54)(H,55,56)
InChI key： RMDSOVJNMZMAEJ-UHFFFAOYSA-N
SMILES： c1cc(ccn1)c1cc2cc(cc3[nH]c(nc(c1)c23)c1ccc(cc1)c1nc2cc(cc3cc(cc([nH]1)c23)c1ccncc1)c1ccncc1)c1ccncc1
Systematic name  (4)：
  • 2,2′-(1,4-フェニレン)ビス[5,8-ビス(4-ピリジル)-1,3-ジアザ-1H-フェナレン]
  • 2,2′-(1,4-フェニレン)ビス(5,8-ジ(4-ピリジル)-1H-ペリミジン)
  • 2-{4-[5,8-ビス(ピリジン-4-イル)-1H-ペリミジン-2-イル]フェニル}-5,8-ビス(ピリジン-4-イル)-1H-ペリミジン
  • 2-{4-[5,8-bis(pyridin-4-yl)-1H-perimidin-2-yl]phenyl}-5,8-bis(pyridin-4-yl)-1H-perimidine
Other name (2)：
  • 2,2′-(1,4-Phenylene)bis[5,8-bis(4-pyridyl)-1,3-diaza-1H-phenalene]
  • 2,2′-(1,4-Phenylene)bis(5,8-di(4-pyridyl)-1H-perimidine)
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