Geometry & MOs

Info

ID:	264489
PubChem CID:	103464029
Reduced:	ON3C17H17 (1)
Stoich.:	AB3C17D17 (1)
Weight, g/mol:	305.118257
ΔH_f, kcal/mol:	46.58
Dipole, Da:	4.06
IP(EA), eV:	-8.53(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-4-ethoxy-N-(2-methoxy-1-phenylethyl)aniline

Drug info:

PubChemData

Smile

COCC(C1=CC=CC=C1)NC2=CC3=NC=CN=C3C=C2

DOS

IR

Vibrations