Geometry & MOs

Info

ID:	374551
PubChem CID:	131331465
Reduced:	BrOSC12H13 (1)
Stoich.:	ABCD12E13 (1)
Weight, g/mol:	283.98705
ΔH_f, kcal/mol:	-17.01
Dipole, Da:	1.49
IP(EA), eV:	-8.18(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(bromomethyl)-4-ethyl-7-methoxy-1-benzothiophene

Drug info:

PubChemData

Smile

CCC1=CSC2=C1C=C(C=C2OC)CBr

DOS

IR

Vibrations