Geometry & MOs

Info

ID:	372866
PubChem CID:	131306272
Reduced:	BrClOSH10C11 (1)
Stoich.:	ABCDE10F11 (1)
Weight, g/mol:	303.93243
ΔH_f, kcal/mol:	-14.53
Dipole, Da:	3.18
IP(EA), eV:	-8.64(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-bromo-3-(chloromethyl)-5-ethoxy-1-benzothiophene

Drug info:

PubChemData

Smile

CCOC1=C(C2=C(C=C1)C=C(S2)CCl)Br

DOS

IR

Vibrations