Geometry & MOs

Info

ID:	283478
PubChem CID:	103984296
Reduced:	ClNOC15H24 (1)
Stoich.:	ABCD15E24 (1)
Weight, g/mol:	227.107692
ΔH_f, kcal/mol:	-55.41
Dipole, Da:	3.3
IP(EA), eV:	-8.88(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-chlorophenyl)methyl]-3-methoxy-N-methylpropan-1-amine

Drug info:

PubChemData

Smile

CC(C)CNCC(CC1=CC=C(C=C1)Cl)COC

DOS

IR

Vibrations