Geometry & MOs

Info

ID:	177708
PubChem CID:	76219396
Reduced:	O3C11H12 (1)
Stoich.:	A3B11C12 (1)
Weight, g/mol:	195.125929
ΔH_f, kcal/mol:	-107.98
Dipole, Da:	5.27
IP(EA), eV:	-9.04(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-amino-1-hydroxypropan-2-yl)-4,5-dimethylphenol

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)O)C=C(C)C(=O)O

DOS

IR

Vibrations