Geometry & MOs

Info

ID:	4461
PubChem CID:	11440
Reduced:	O3C11H14 (1)
Stoich.:	A3B11C14 (1)
Weight, g/mol:	194.094294
ΔH_f, kcal/mol:	-134.7
Dipole, Da:	5.08
IP(EA), eV:	-9.47(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-hydroxy-2-methyl-5-propan-2-ylbenzoic acid

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1C(=O)O)C(C)C)O

DOS

IR

Vibrations