Geometry & MOs

Info

ID:	46440
PubChem CID:	10524418
Reduced:	BrSO2N3H12C16 (1)
Stoich.:	ABC2D3E12F16 (1)
Weight, g/mol:	389.058549
ΔH_f, kcal/mol:	9.18
Dipole, Da:	3.82
IP(EA), eV:	-9.03(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3,4-dichlorophenyl)methyl]-4-(5-methoxy-1-benzofuran-2-yl)pyrrolidin-2-one

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)N(C(=O)S2)CC(=O)N/N=C/C3=CC=C(C=C3)Br

DOS

IR

Vibrations