Geometry & MOs

Info

ID:	212199
PubChem CID:	81059800
Reduced:	BrN2O2C14H23 (1)
Stoich.:	AB2C2D14E23 (1)
Weight, g/mol:	253.098394
ΔH_f, kcal/mol:	-59.52
Dipole, Da:	1.87
IP(EA), eV:	-8.86(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-ethoxyethyl(methyl)sulfamoyl]butanoic acid

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations