Geometry & MOs

Info

ID:	23572
PubChem CID:	604709
Reduced:	O3H8C11 (1)
Stoich.:	A3B8C11 (1)
Weight, g/mol:	188.047344
ΔH_f, kcal/mol:	-72.38
Dipole, Da:	2.74
IP(EA), eV:	-9.85(-1.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-3-oxoindene-1-carboxylic acid

Drug info:

PubChemData

Smile

CC1=C(C2=CC=CC=C2C1=O)C(=O)O

DOS

IR

Vibrations