Compound Identification
SMILES
[Fe++].[Fe++].[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.N#CC1=C(C=C(C#C[C]2[CH][CH][CH][CH]2)C(=C1)C#C[C]1[CH][CH][CH][CH]1)C#N
InChIKey
InChIKey=QNBBFWKWYZMTDA-UHFFFAOYSA-N
Formula
C32H20Fe2N2
Mass
544.214
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzonitriles
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzonitriles
Intermediate Tree Nodes
Not available
Direct Parent
Benzonitriles
Alternative Parents
Organic transition metal salts Nitriles Cycloalkenes Unsaturated aliphatic hydrocarbons Organopnictogen compounds Hydrocarbon derivatives Organic cations
Molecular Framework
Not available
Substituents
Benzonitrile - Cyclic olefin - Cycloalkene - Carbonitrile - Nitrile - Organic transition metal salt - Organic nitrogen compound - Organopnictogen compound - Cyanide - Hydrocarbon derivative - Organonitrogen compound - Olefin - Unsaturated hydrocarbon - Unsaturated aliphatic hydrocarbon - Hydrocarbon - Organic cation - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzonitriles. These are organic compounds containing a benzene bearing a nitrile substituent.
External Descriptors
Not available