Geometry & MOs

Info

ID:	238231
PubChem CID:	92729817
Reduced:	N3O4C23H27 (1)
Stoich.:	A3B4C23D27 (1)
Weight, g/mol:	413.150619
ΔH_f, kcal/mol:	-138.34
Dipole, Da:	3.7
IP(EA), eV:	-8.97(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-[4-[(4-chlorobenzoyl)amino]benzoyl]-N-propan-2-ylpyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)NC(=O)[C@@H]1CCCN1C(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)OC

DOS

IR

Vibrations