Geometry & MOs

Info

ID:	210068
PubChem CID:	80757758
Reduced:	N2F3O4C12H13 (1)
Stoich.:	A2B3C4D12E13 (1)
Weight, g/mol:	256.085935
ΔH_f, kcal/mol:	-318.54
Dipole, Da:	4.28
IP(EA), eV:	-10.32(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[(4-fluoro-2-methylphenyl)carbamoylamino]-3-hydroxypropanoic acid

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CNC(=O)N[C@H](CO)C(=O)O)C(F)(F)F

DOS

IR

Vibrations