Geometry & MOs

Info

ID:	23892
PubChem CID:	607023
Reduced:	ClSN2O3H9C15 (1)
Stoich.:	ABC2D3E9F15 (1)
Weight, g/mol:	332.002241
ΔH_f, kcal/mol:	15.37
Dipole, Da:	10.05
IP(EA), eV:	-9.24(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-N-(3-nitrophenyl)-1-benzothiophene-2-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=C(S2)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-])Cl

DOS

IR

Vibrations