Geometry & MOs

Info

ID:	145711
PubChem CID:	53579796
Reduced:	FO2N4C17H25 (1)
Stoich.:	AB2C4D17E25 (1)
Weight, g/mol:	325.119319
ΔH_f, kcal/mol:	-32.19
Dipole, Da:	6.74
IP(EA), eV:	-8.78(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-chloro-5-(hydroxymethyl)anilino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide

Drug info:

PubChemData

Smile

CN1CCCCC1CN2CCN(CC2)C3=C(C(=CC=C3)F)[N+](=O)[O-]

DOS

IR

Vibrations