Geometry & MOs

Info

ID:	282607
PubChem CID:	103932648
Reduced:	NO2C12H25 (1)
Stoich.:	AB2C12D25 (1)
Weight, g/mol:	361.01749
ΔH_f, kcal/mol:	-127.36
Dipole, Da:	2.16
IP(EA), eV:	-9.25(1.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(2-iodo-3-methylbenzoyl)amino]pentanoic acid

Drug info:

PubChemData

Smile

CCCCC(CCC)NC1COCC1O

DOS

IR

Vibrations