Geometry & MOs

Info

ID:	270963
PubChem CID:	103639021
Reduced:	BrOSN2H9C11 (1)
Stoich.:	ABCD2E9F11 (1)
Weight, g/mol:	344.9823
ΔH_f, kcal/mol:	21.81
Dipole, Da:	4.74
IP(EA), eV:	-9.51(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-bromo-2-methylphenyl)-1-benzothiophene-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1Br)NC(=O)C2=CN=CS2

DOS

IR

Vibrations