Geometry & MOs

Info

ID:	62460
PubChem CID:	26719743
Reduced:	ClSN4O5H19C23 (1)
Stoich.:	ABC4D5E19F23 (1)
Weight, g/mol:	305.007741
ΔH_f, kcal/mol:	-44.9
Dipole, Da:	6.11
IP(EA), eV:	-8.81(-2.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-chlorophenyl)-5-fluoro-1-benzothiophene-2-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=CN2)C[C@@H](C(=O)NC3=CC(=CC=C3)Cl)NS(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

DOS

IR

Vibrations