Geometry & MOs

Info

ID:	240837
PubChem CID:	93617761
Reduced:	N2O3C10H12 (1)
Stoich.:	A2B3C10D12 (1)
Weight, g/mol:	176.079707
ΔH_f, kcal/mol:	-102.96
Dipole, Da:	3.71
IP(EA), eV:	-9.96(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3S)-3-hydroxy-2-(methylcarbamoylamino)butanoic acid

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations