Geometry & MOs

Info

ID:	35984
PubChem CID:	7980597
Reduced:	ClNO3H18C21 (1)
Stoich.:	ABC3D18E21 (1)
Weight, g/mol:	403.178358
ΔH_f, kcal/mol:	-84.98
Dipole, Da:	4.41
IP(EA), eV:	-9.01(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]-N-[4-(4-methylphenoxy)phenyl]acetamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)Cl)NC(=O)COC(=O)C2=CC3=CC=CC=C3C=C2)C

DOS

IR

Vibrations