Geometry & MOs

Info

ID:	22222
PubChem CID:	596329
Reduced:	NO4C18H21 (1)
Stoich.:	AB4C18D21 (1)
Weight, g/mol:	315.147058
ΔH_f, kcal/mol:	-114.53
Dipole, Da:	1.58
IP(EA), eV:	-8.32(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3,4-dimethoxyphenyl)ethyl]-3-methoxybenzamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)CCNC(=O)C2=CC(=CC=C2)OC)OC

DOS

IR

Vibrations