Geometry & MOs

Info

ID:	8
PubChem CID:	1936
Reduced:	N2O7C11H18 (1)
Stoich.:	A2B7C11D18 (1)
Weight, g/mol:	290.111401
ΔH_f, kcal/mol:	-300.01
Dipole, Da:	5.76
IP(EA), eV:	-10.06(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-acetamido-2-(3-amino-1,2-dihydroxypropyl)-4-hydroxy-3,4-dihydro-2H-pyran-6-carboxylic acid

Drug info:

PubChemData

Smile

CC(=O)NC1C(C=C(OC1C(C(CN)O)O)C(=O)O)O

DOS

IR

Vibrations