Geometry & MOs

Info

ID:	213878
PubChem CID:	81065509
Reduced:	NO4C11H21 (1)
Stoich.:	AB4C11D21 (1)
Weight, g/mol:	313.098394
ΔH_f, kcal/mol:	-206.03
Dipole, Da:	3.98
IP(EA), eV:	-9.96(0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[(4-methylsulfonylbenzoyl)amino]methyl]pentanoic acid

Drug info:

PubChemData

Smile

CCC(CC(=O)O)CNC(=O)CCOCC

DOS

IR

Vibrations