Geometry & MOs

Info

ID:	446817
PubChem CID:	135277964
Reduced:	N2O3H18C21 (1)
Stoich.:	A2B3C18D21 (1)
Weight, g/mol:	281.074681
ΔH_f, kcal/mol:	-53.59
Dipole, Da:	5.7
IP(EA), eV:	-9.04(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-3-[(5R)-3,4,5,6-tetrahydroxyoxane-2-carbonyl]oxypropanoic acid

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)NC(=O)NC3=CC=CC=C3

DOS

IR

Vibrations