Geometry & MOs

Info

ID:	124237
PubChem CID:	50876034
Reduced:	ClSO3C12H17 (1)
Stoich.:	ABC3D12E17 (1)
Weight, g/mol:	297.90661
ΔH_f, kcal/mol:	-141.77
Dipole, Da:	8.9
IP(EA), eV:	-9.52(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-3-ethoxybenzenesulfonyl chloride

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C(=C1)C)C(C)C)S(=O)(=O)Cl

DOS

IR

Vibrations