Geometry & MOs

Info

ID:

144059

PubChem CID:

53305931

Reduced:

N3O3H19C24 (1)

Stoich.:

A3B3C19D24 (1)

Weight, g/mol:

169.085127

ΔHf, kcal/mol:

12.06

Dipole, Da:

5.95

IP(EA), eV:

-8.15(-1.02)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(2S)-3-amino-2-imidazol-1-yl-2-methylpropanoic acid

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)C2=NC(=C3N2C=CC=C3)/C=C/4\C5=CC=CC=C5NC4=O)OC

DOS

IR

Vibrations