Geometry & MOs

Info

ID:	62467
PubChem CID:	26719750
Reduced:	ClN2O3C19H19 (1)
Stoich.:	AB2C3D19E19 (1)
Weight, g/mol:	364.064841
ΔH_f, kcal/mol:	-97.24
Dipole, Da:	5.27
IP(EA), eV:	-9.16(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(3-chloroanilino)-3-oxopropyl]-4-oxo-4-thiophen-2-ylbutanamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)CCC(=O)NCCC(=O)NC2=CC(=CC=C2)Cl

DOS

IR

Vibrations