Geometry & MOs

Info

ID:	196245
PubChem CID:	78802196
Reduced:	SN3O3C15H23 (1)
Stoich.:	AB3C3D15E23 (1)
Weight, g/mol:	337.167794
ΔH_f, kcal/mol:	-110.2
Dipole, Da:	5.23
IP(EA), eV:	-8.68(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3,4-dimethoxyphenyl)methyl]-1-(6-methoxynaphthalen-2-yl)methanamine

Drug info:

PubChemData

Smile

CCC(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)CC

DOS

IR

Vibrations