Geometry & MOs

Info

ID:	449641
PubChem CID:	135300217
Reduced:	O3C15H16 (1)
Stoich.:	A3B15C16 (1)
Weight, g/mol:	345.212636
ΔH_f, kcal/mol:	-102.59
Dipole, Da:	5.62
IP(EA), eV:	-9.6(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dibutyl-3-methoxy-4-(2-thiophen-2-ylethyl)aniline

Drug info:

PubChemData

Smile

CC1=CC(=O)CC(C1)C(=O)OCC2=CC=CC=C2

DOS

IR

Vibrations