Geometry & MOs

Info

ID:	213440
PubChem CID:	81063729
Reduced:	BrClFNSO3C12H16 (1)
Stoich.:	ABCDEF3G12H16 (1)
Weight, g/mol:	319.100892
ΔH_f, kcal/mol:	-159.63
Dipole, Da:	4.35
IP(EA), eV:	-9.76(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(chloromethyl)-N-(2-ethoxyethyl)-2-ethyl-N-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

CCOCCN(C)S(=O)(=O)C1=CC(=CC(=C1F)CCl)Br

DOS

IR

Vibrations