Geometry & MOs

Info

ID:	56377
PubChem CID:	17425255
Reduced:	ClN3O3C18H24 (1)
Stoich.:	AB3C3D18E24 (1)
Weight, g/mol:	418.036576
ΔH_f, kcal/mol:	-136.63
Dipole, Da:	4.61
IP(EA), eV:	-8.9(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(5-chlorothiophen-2-yl)-N-methyl-4-oxo-N-[2-oxo-2-(2,3,4-trifluoroanilino)ethyl]butanamide

Drug info:

PubChemData

Smile

CC1C(=O)N(C(=O)N1C2=CC=C(C=C2)Cl)CC(=O)N(C(C)C)C(C)C

DOS

IR

Vibrations