Geometry & MOs

Info

ID:	197120
PubChem CID:	78924474
Reduced:	ON2F3C12H23 (1)
Stoich.:	AB2C3D12E23 (1)
Weight, g/mol:	248.116092
ΔH_f, kcal/mol:	-241.73
Dipole, Da:	7.08
IP(EA), eV:	-9.56(0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(3-hydroxyphenyl)ethyl]-5-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CCC(CC)CN(CC)C(=O)CNCC(F)(F)F

DOS

IR

Vibrations