Geometry & MOs

Info

ID:	59946
PubChem CID:	26512235
Reduced:	N3O4C22H27 (1)
Stoich.:	A3B4C22D27 (1)
Weight, g/mol:	373.212732
ΔH_f, kcal/mol:	-112.12
Dipole, Da:	5.24
IP(EA), eV:	-8.1(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

(3,4-dimethoxyphenyl)methyl-methyl-[2-[2-(3-methylphenoxy)ethylamino]-2-oxoethyl]azanium

Drug info:

PubChemData

Smile

C[C@@H]1CC(=O)NC2=CC=CC=C2N1C(=O)CN(C)CC3=CC(=C(C=C3)OC)OC

DOS

IR

Vibrations