Geometry & MOs

Info

ID:	262433
PubChem CID:	103292970
Reduced:	ClN2O4C14H19 (1)
Stoich.:	AB2C4D14E19 (1)
Weight, g/mol:	271.097521
ΔH_f, kcal/mol:	-164.57
Dipole, Da:	2.61
IP(EA), eV:	-9.07(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(2-chloro-6-methoxyphenyl)methylamino]pentanoic acid

Drug info:

PubChemData

Smile

CC(=O)NC(CNCC1=C(C=CC=C1Cl)OC)C(=O)OC

DOS

IR

Vibrations