Geometry & MOs

Info

ID:	303489
PubChem CID:	124489811
Reduced:	INO4C15H20 (1)
Stoich.:	ABC4D15E20 (1)
Weight, g/mol:	205.110279
ΔH_f, kcal/mol:	-167.18
Dipole, Da:	5.83
IP(EA), eV:	-9.6(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z,3S)-3-amino-6-phenylhex-5-enoic acid

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations