Geometry & MOs

Info

ID:	276352
PubChem CID:	103822358
Reduced:	FNO3C15H20 (1)
Stoich.:	ABC3D15E20 (1)
Weight, g/mol:	389.04879
ΔH_f, kcal/mol:	-194.14
Dipole, Da:	2.27
IP(EA), eV:	-9.85(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (2S)-2-[(2-iodo-3-methylbenzoyl)amino]propanoate

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)F)C(=O)N[C@@H](C)C(=O)OC(C)(C)C

DOS

IR

Vibrations