Geometry & MOs

Info

ID:	373978
PubChem CID:	131321963
Reduced:	BrFOSH10C11 (1)
Stoich.:	ABCDE10F11 (1)
Weight, g/mol:	287.96198
ΔH_f, kcal/mol:	-51.78
Dipole, Da:	1.78
IP(EA), eV:	-8.71(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(bromomethyl)-7-ethoxy-6-fluoro-1-benzothiophene

Drug info:

PubChemData

Smile

CCOC1=C(C=C2C=CSC2=C1F)CBr

DOS

IR

Vibrations