Geometry & MOs

Info

ID:	448293
PubChem CID:	135289949
Reduced:	ClNO4C21H22 (1)
Stoich.:	ABC4D21E22 (1)
Weight, g/mol:	372.12407
ΔH_f, kcal/mol:	-88.58
Dipole, Da:	2.3
IP(EA), eV:	-8.65(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-(3-chlorophenyl)-3-(4-methoxy-3-morpholin-4-ylphenyl)prop-2-enamide

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)C2CC2C(=O)NC3=CC=C(C=C3)Cl)OCC4COC4

DOS

IR

Vibrations