Geometry & MOs

Info

ID:	150311
PubChem CID:	53789999
Reduced:	N5H19C23 (1)
Stoich.:	A5B19C23 (1)
Weight, g/mol:	329.141579
ΔH_f, kcal/mol:	126.58
Dipole, Da:	1.43
IP(EA), eV:	-8.55(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzyl-3-[(5-phenylfuran-2-yl)methylidene]pyrrolidin-2-one

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1)N2C3=CC=CC=C3C4=C(N=C(N=C42)C5=CC=CC=N5)N

DOS

IR

Vibrations