Structure Information
Structure

Compound Identification

SMILES

[Ir].CC(=O)CC(C)=O.CCCCC1=CC=CC(=[C-]1)C1=NC2=C3C(C=CC4=C(N=C(C5=CC=CC=C5)C(C=C2)=C34)C2=CC=CC=C2)=N1.CCCCC1=CC=CC(=[C-]1)C1=NC2=C3C(C=CC4=C(N=C(C5=CC=CC=C5)C(C=C2)=C34)C2=CC=CC=C2)=N1

InChIKey

InChIKey=HBXQSQINTCSTEX-UHFFFAOYSA-N

Formula

C75H60IrN6O2

Mass

1269.563

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Diazanaphthalenes

Subclass

Benzodiazines

Intermediate Tree Nodes

Quinazolines

Direct Parent

Perimidines

Alternative Parents

Molecular Framework

Not available

Substituents

Perimidine - 2-phenylpyridine - Isoquinoline - Naphthalene - 1,3-diketone - Monocyclic benzene moiety - Pyridine - Pyrimidine - 1,3-dicarbonyl compound - Benzenoid - Heteroaromatic compound - Ketone - Organic transition metal salt - Azacycle - Organic nitrogen compound - Carbonyl group - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic anion - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as perimidines. These are organic compounds containing a benzene ring fused to a quinazoline ring system. They are analogues of phenalenes where two carbon atoms in exactly one ring are replaced by nitrogen atoms to form a pyrimidine.

External Descriptors

Not available

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