Geometry & MOs

Info

ID:	54558
PubChem CID:	17388890
Reduced:	N2O4C17H18 (1)
Stoich.:	A2B4C17D18 (1)
Weight, g/mol:	437.183838
ΔH_f, kcal/mol:	-110.09
Dipole, Da:	3.42
IP(EA), eV:	-8.9(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[benzyl(2-phenylethyl)amino]methyl]-6-methoxyphenol;oxalic acid

Drug info:

PubChemData

Smile

C1CN(CC2=CC=CC=C21)CC3=CC=CC=N3.C(=O)(C(=O)O)O

DOS

IR

Vibrations