Geometry & MOs

Info

ID:	410718
PubChem CID:	135083519
Reduced:	NSO2C11H15 (1)
Stoich.:	ABC2D11E15 (1)
Weight, g/mol:	179.079373
ΔH_f, kcal/mol:	-77.06
Dipole, Da:	1.61
IP(EA), eV:	-9.28(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,5S)-2-amino-6-(hydroxymethyl)oxane-3,4,5-triol

Drug info:

PubChemData

Smile

C[C@@H](CS)NC(=O)OCC1=CC=CC=C1

DOS

IR

Vibrations