Geometry & MOs

Info

ID:	194474
PubChem CID:	78542025
Reduced:	ClO2H17C22 (1)
Stoich.:	AB2C17D22 (1)
Weight, g/mol:	386.103335
ΔH_f, kcal/mol:	-8.74
Dipole, Da:	2.3
IP(EA), eV:	-9.38(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(4-acetamidoanilino)-1-oxopropan-2-yl] 3-(3-chlorophenyl)prop-2-enoate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(C=C2)COC(=O)C=CC3=CC=CC=C3Cl

DOS

IR

Vibrations