Geometry & MOs

Info

ID:	37428
PubChem CID:	8020967
Reduced:	ClNO4C16H18 (1)
Stoich.:	ABC4D16E18 (1)
Weight, g/mol:	364.142307
ΔH_f, kcal/mol:	-137.53
Dipole, Da:	8.77
IP(EA), eV:	-8.69(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-oxo-2-[2-(phenylcarbamoyl)anilino]ethyl] (2E,4E)-hexa-2,4-dienoate

Drug info:

PubChemData

Smile

C/C=C/C=C/C(=O)O[C@@H](C)C(=O)NC1=C(C=CC(=C1)Cl)OC

DOS

IR

Vibrations