Geometry & MOs

Info

ID:	124164
PubChem CID:	50873690
Reduced:	ClNO2C13H14 (1)
Stoich.:	ABC2D13E14 (1)
Weight, g/mol:	241.030584
ΔH_f, kcal/mol:	-79.88
Dipole, Da:	2.71
IP(EA), eV:	-8.78(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-fluorophenyl)-5-oxopyrrolidine-3-carbonyl chloride

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)N2CC(CC2=O)C(=O)Cl

DOS

IR

Vibrations