Geometry & MOs

Info

ID:	187442
PubChem CID:	77572203
Reduced:	OF2N4C31H36 (1)
Stoich.:	AB2C4D31E36 (1)
Weight, g/mol:	231.162314
ΔH_f, kcal/mol:	-77.36
Dipole, Da:	3.54
IP(EA), eV:	-8.05(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-benzyl-1-(2-methylpropyl)pyrrolidin-2-one

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)N2CCN(CC2)C(=O)C3CC(CN3CC4=CC=CC=C4)NCC5=C(C=C(C=C5)F)F)C

DOS

IR

Vibrations