Geometry & MOs

Info

ID:	282610
PubChem CID:	103932807
Reduced:	NF3O4C9H14 (1)
Stoich.:	AB3C4D9E14 (1)
Weight, g/mol:	332.97673
ΔH_f, kcal/mol:	-352.43
Dipole, Da:	4.73
IP(EA), eV:	-10.37(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(2-bromo-5-chlorobenzoyl)amino]pentanoic acid

Drug info:

PubChemData

Smile

CC(CCC(=O)O)NC(=O)COCC(F)(F)F

DOS

IR

Vibrations