Geometry & MOs

Info

ID:	212097
PubChem CID:	81059494
Reduced:	NOC8H14 (2)
Stoich.:	ABC8D14 (2)
Weight, g/mol:	364.99326
ΔH_f, kcal/mol:	-79.44
Dipole, Da:	3.88
IP(EA), eV:	-8.62(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-5-[2-ethoxyethyl(methyl)sulfamoyl]benzoic acid

Drug info:

PubChemData

Smile

CCOCCN(C)C(CN)C1=CC=C(C=C1)OC(C)C

DOS

IR

Vibrations