Compound Identification
SMILES
[Ir+3].CC#N.CC#N.CC#N.[O-]S(=O)(=O)C(F)(F)F.[O-]S(=O)(=O)C(F)(F)F.[O-]S(=O)(=O)C(F)(F)F.CC(CP(C1=CC=CC=C1)C1=CC=CC=C1)(CP(C1=CC=CC=C1)C1=CC=CC=C1)CP(C1=CC=CC=C1)C1=CC=CC=C1
InChIKey
InChIKey=AJECJHNZUNBYRW-UHFFFAOYSA-K
Formula
C50H48F9IrN3O9P3S3
Mass
1387.25
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Organic sulfonic acids and derivatives
-
Subclass
Organosulfonic acids and derivatives
-
Level 5
Alkanesulfonic acids and derivatives
-
Level 6
Alkanesulfonic acids
- Level 7 Trifluoromethanesulfonates
-
Level 6
Alkanesulfonic acids
-
Level 5
Alkanesulfonic acids and derivatives
-
Subclass
Organosulfonic acids and derivatives
-
Class
Organic sulfonic acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Organic sulfonic acids and derivatives
Subclass
Organosulfonic acids and derivatives
Intermediate Tree Nodes
Alkanesulfonic acids and derivatives - Alkanesulfonic acids
Direct Parent
Trifluoromethanesulfonates
Alternative Parents
Benzene and substituted derivatives Sulfonyls Organosulfonic acids Methanesulfonates Trihalomethanes Organic phosphines and derivatives Organic transition metal salts Organic metal halides Nitriles Organopnictogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Not available
Substituents
Trifluoromethanesulfonate - Monocyclic benzene moiety - Benzenoid - Methanesulfonate - Organosulfonic acid - Sulfonyl - Phosphine - Trihalomethane - Carbonitrile - Nitrile - Organic metal halide - Organic transition metal salt - Organic oxide - Organosulfur compound - Organophosphorus compound - Organonitrogen compound - Organofluoride - Organopnictogen compound - Organohalogen compound - Alkyl halide - Alkyl fluoride - Organic oxygen compound - Halomethane - Organic salt - Organic nitrogen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as trifluoromethanesulfonates. These are alkanesulfonic acids, that contain a sulfonate group that is substituted with a trifluoromethyl group.
External Descriptors
Not available