Geometry & MOs

Info

ID:	238283
PubChem CID:	92729939
Reduced:	ClN3O4C23H26 (1)
Stoich.:	AB3C4D23E26 (1)
Weight, g/mol:	411.134969
ΔH_f, kcal/mol:	-139.56
Dipole, Da:	6.35
IP(EA), eV:	-9.31(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-1-[4-[(2-chlorobenzoyl)amino]benzoyl]-N-cyclopropylpyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations