Geometry & MOs

Info

ID:	47904
PubChem CID:	10535788
Reduced:	NOC12H19 (1)
Stoich.:	ABC12D19 (1)
Weight, g/mol:	193.146664
ΔH_f, kcal/mol:	-41.98
Dipole, Da:	1.75
IP(EA), eV:	-9.2(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-methoxyphenyl)ethyl]propan-1-amine

Drug info:

PubChemData

Smile

CCC[C@H](CN)[C@H](C1=CC=CC=C1)O

DOS

IR

Vibrations