Geometry & MOs

Info

ID:	36254
PubChem CID:	7982490
Reduced:	ClSO3N4H17C19 (1)
Stoich.:	ABC3D4E17F19 (1)
Weight, g/mol:	416.173607
ΔH_f, kcal/mol:	-33.56
Dipole, Da:	7.77
IP(EA), eV:	-8.98(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-oxo-2-pyrrolidin-1-ylethyl) 2-[(2-naphthalen-1-ylacetyl)amino]benzoate

Drug info:

PubChemData

Smile

CC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NNC(=N2)C3=C(C=CC(=C3)Cl)OC

DOS

IR

Vibrations