Geometry & MOs

Info

ID:	213347
PubChem CID:	81063500
Reduced:	BrClFNSO4C12H14 (1)
Stoich.:	ABCDEF4G12H14 (1)
Weight, g/mol:	372.970912
ΔH_f, kcal/mol:	-188.13
Dipole, Da:	8.21
IP(EA), eV:	-9.64(-1.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations