Geometry & MOs

Info

ID:	141414
PubChem CID:	52874854
Reduced:	O3N5C22H25 (1)
Stoich.:	A3B5C22D25 (1)
Weight, g/mol:	366.194343
ΔH_f, kcal/mol:	-88.68
Dipole, Da:	6.53
IP(EA), eV:	-8.87(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-N-cyclopropyl-1-(3,4-dimethylphenyl)-N-[(1R)-1-(furan-2-yl)ethyl]-2-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CCNC(=O)C1=CC(=C(C=C1)C)NC(=O)[C@@H](CC2=CNC3=CC=CC=C32)NC(=O)N

DOS

IR

Vibrations