Geometry & MOs

Info

ID:	189241
PubChem CID:	77831553
Reduced:	NO2H8C10 (2)
Stoich.:	AB2C8D10 (2)
Weight, g/mol:	336.153266
ΔH_f, kcal/mol:	-69.75
Dipole, Da:	8.68
IP(EA), eV:	-9.91(-1.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxypropylamino]acetic acid

Drug info:

PubChemData

Smile

CC(C1CNC1=O)(C(=O)C2=CC=CC=C2)N3C(=O)C4=CC=CC=C4C3=O

DOS

IR

Vibrations