Geometry & MOs

Info

ID:	375183
PubChem CID:	131472793
Reduced:	SN5C9H11 (1)
Stoich.:	AB5C9D11 (1)
Weight, g/mol:	286.92518
ΔH_f, kcal/mol:	76.34
Dipole, Da:	3.05
IP(EA), eV:	-8.52(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-2-methoxy-5-nitro-1-benzothiophene

Drug info:

PubChemData

Smile

CCC1=NC(=C(S1)N)C2=CN=C(N=N2)C

DOS

IR

Vibrations