Geometry & MOs

Info

ID:	398316
PubChem CID:	135032798
Reduced:	OSH14C21 (1)
Stoich.:	ABC14D21 (1)
Weight, g/mol:	209.085207
ΔH_f, kcal/mol:	52.81
Dipole, Da:	3.77
IP(EA), eV:	-8.95(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E,2S)-2-amino-5-(2-fluorophenyl)pent-4-enoic acid

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC(=O)C4=CC=CC=C4S3

DOS

IR

Vibrations