Geometry & MOs

Info

ID:	408004
PubChem CID:	135080759
Reduced:	O3C13H14 (1)
Stoich.:	A3B13C14 (1)
Weight, g/mol:	179.131014
ΔH_f, kcal/mol:	-61.71
Dipole, Da:	1.77
IP(EA), eV:	-9.5(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(dimethylamino)-2-propylphenol

Drug info:

PubChemData

Smile

CC(=O)O[C@@H]1C=CC[C@H]2C=CC=C[C@@H]1C2=O

DOS

IR

Vibrations