Geometry & MOs

Info

ID:	295487
PubChem CID:	117531262
Reduced:	FN2O2C13H17 (1)
Stoich.:	AB2C2D13E17 (1)
Weight, g/mol:	233.105193
ΔH_f, kcal/mol:	-123.34
Dipole, Da:	3.09
IP(EA), eV:	-9.37(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-methylphenyl)methyl 3-oxopyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

C1CC(CN(C1)C(=O)OCC2=CC=C(C=C2)F)N

DOS

IR

Vibrations