Geometry & MOs

Info

ID:	213298
PubChem CID:	81063378
Reduced:	BrClNSO4C13H17 (1)
Stoich.:	ABCDE4F13G17 (1)
Weight, g/mol:	372.970912
ΔH_f, kcal/mol:	-156.93
Dipole, Da:	5.25
IP(EA), eV:	-9.75(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5-dichloro-3-[2-ethoxyethyl(methyl)carbamoyl]benzenesulfonyl chloride

Drug info:

PubChemData

Smile

CCOCCN(C)C(=O)C1=C(C(=CC(=C1)S(=O)(=O)Cl)Br)C

DOS

IR

Vibrations