Geometry & MOs

Info

ID:	58797
PubChem CID:	24714874
Reduced:	NOC16H27 (1)
Stoich.:	ABC16D27 (1)
Weight, g/mol:	277.204179
ΔH_f, kcal/mol:	-66.88
Dipole, Da:	2.66
IP(EA), eV:	-8.53(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-1-[(4-methylphenyl)methyl-(oxolan-2-ylmethyl)amino]propan-2-ol

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations