Geometry & MOs

Info

ID:	303490
PubChem CID:	124489812
Reduced:	NO2C12H15 (1)
Stoich.:	AB2C12D15 (1)
Weight, g/mol:	205.110279
ΔH_f, kcal/mol:	-61.71
Dipole, Da:	4.92
IP(EA), eV:	-9.45(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)/C=C\C[C@@H](CC(=O)O)N

DOS

IR

Vibrations