Geometry & MOs

Info

ID:	336835
PubChem CID:	127255842
Reduced:	NO8C15H21 (1)
Stoich.:	AB8C15D21 (1)
Weight, g/mol:	304.163436
ΔH_f, kcal/mol:	-338.82
Dipole, Da:	5.42
IP(EA), eV:	-9.26(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-3-amino-2-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoic acid

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations