Geometry & MOs

Info

ID:	373798
PubChem CID:	131320143
Reduced:	BrO2S2H9C11 (1)
Stoich.:	AB2C2D9E11 (1)
Weight, g/mol:	265.953533
ΔH_f, kcal/mol:	-45.72
Dipole, Da:	5.25
IP(EA), eV:	-9.12(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-5-(chloromethyl)-4-(difluoromethyl)-1-benzothiophene

Drug info:

PubChemData

Smile

CSC1=CSC2=C1C=C(C(=C2)C(=O)O)CBr

DOS

IR

Vibrations