Geometry & MOs

Info

ID:	438921
PubChem CID:	135228682
Reduced:	O2N3C20H21 (1)
Stoich.:	A2B3C20D21 (1)
Weight, g/mol:	221.177964
ΔH_f, kcal/mol:	22.04
Dipole, Da:	6.31
IP(EA), eV:	-8.81(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-methoxy-3-methylphenyl)-3,3-dimethylbutan-2-amine

Drug info:

PubChemData

Smile

CCONC1=CC=CC(=C1)C(CC2C3=CC=CC=C3C4=CN=CN24)O

DOS

IR

Vibrations