Geometry & MOs

Info

ID:	171381
PubChem CID:	75369516
Reduced:	FN2O4H9C14 (1)
Stoich.:	AB2C4D9E14 (1)
Weight, g/mol:	348.094392
ΔH_f, kcal/mol:	-61.41
Dipole, Da:	4.3
IP(EA), eV:	-8.93(-1.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methyl-1,3-thiazol-5-yl)ethyl 1-(4-fluorophenyl)-2-oxopyrrolidine-3-carboxylate

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)F)CN2C=CC3=C(C2=O)C=CO3)[N+](=O)[O-]

DOS

IR

Vibrations