Geometry & MOs

Info

ID:	194397
PubChem CID:	78528935
Reduced:	N3O6C21H25 (1)
Stoich.:	A3B6C21D25 (1)
Weight, g/mol:	413.162708
ΔH_f, kcal/mol:	-226.45
Dipole, Da:	3.96
IP(EA), eV:	-9.48(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl) 3-methylbenzo[g][1]benzofuran-2-carboxylate

Drug info:

PubChemData

Smile

C1CCC2(C1)C(=O)N(C(=O)N2)CC(=O)OC(C3=CC=CC=C3)C(=O)N4CCOCC4

DOS

IR

Vibrations