Geometry & MOs

Info

ID:	203752
PubChem CID:	79864310
Reduced:	NC7H15 (2)
Stoich.:	AB7C15 (2)
Weight, g/mol:	272.083078
ΔH_f, kcal/mol:	-43.27
Dipole, Da:	2.6
IP(EA), eV:	-8.11(2.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-2-[methyl(2-methylsulfonylethyl)amino]benzoic acid

Drug info:

PubChemData

Smile

CCC(C)N(C)C1CCC(C1NCC)(C)C

DOS

IR

Vibrations