Geometry & MOs

Info

ID:	258581
PubChem CID:	103155390
Reduced:	FN2O4C12H15 (1)
Stoich.:	AB2C4D12E15 (1)
Weight, g/mol:	266.126657
ΔH_f, kcal/mol:	-203.65
Dipole, Da:	1.48
IP(EA), eV:	-9.57(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-amino-3-methoxybutanoyl)amino]-5-methylbenzoic acid

Drug info:

PubChemData

Smile

COC(CC(=O)NC1=C(C(=CC=C1)F)C(=O)O)CN

DOS

IR

Vibrations