Geometry & MOs

Info

ID:	131491
PubChem CID:	51212851
Reduced:	O2N5C16H17 (1)
Stoich.:	A2B5C16D17 (1)
Weight, g/mol:	347.110376
ΔH_f, kcal/mol:	41.78
Dipole, Da:	3.16
IP(EA), eV:	-9.3(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-N-(4-fluorophenyl)-2-[2-(2-oxopyrrolidin-1-yl)-1,3-thiazol-4-yl]acetamide

Drug info:

PubChemData

Smile

CC1=CC(=NO1)C(=O)N2CCC(CC2)C3=NN=C4N3C=CC=C4

DOS

IR

Vibrations