Geometry & MOs

Info

ID:	240903
PubChem CID:	93618117
Reduced:	OSF3N3C14H14 (1)
Stoich.:	ABC3D3E14F14 (1)
Weight, g/mol:	344.119464
ΔH_f, kcal/mol:	-131.5
Dipole, Da:	3.6
IP(EA), eV:	-9.1(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-1-(furan-2-ylmethyl)-4-[(2R)-2-thiophen-3-ylpyrrolidine-1-carbonyl]pyrrolidin-2-one

Drug info:

PubChemData

Smile

C1C[C@@H](N(C1)C(=O)CN2C=CC(=N2)C(F)(F)F)C3=CSC=C3

DOS

IR

Vibrations