Geometry & MOs

Info

ID:	177709
PubChem CID:	76219891
Reduced:	NO2C11H17 (1)
Stoich.:	AB2C11D17 (1)
Weight, g/mol:	197.068808
ΔH_f, kcal/mol:	-95.32
Dipole, Da:	2.69
IP(EA), eV:	-8.54(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-2-(2,6-dihydroxyphenyl)propanoic acid

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1C)O)C(C)(CO)N

DOS

IR

Vibrations