Geometry & MOs

Info

ID:	323874
PubChem CID:	126676398
Reduced:	NOC11H11 (1)
Stoich.:	ABC11D11 (1)
Weight, g/mol:	337.1849
ΔH_f, kcal/mol:	32.52
Dipole, Da:	3.5
IP(EA), eV:	-9.25(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,4R,6S)-5-amino-6-[(1R,3R,4R)-4,6-diamino-2,3-dihydroxycyclohexyl]oxy-2-(1-hydroxyethyl)oxane-3,4-diol

Drug info:

PubChemData

Smile

CCC1=CC(=CC=C1)C2=CON=C2

DOS

IR

Vibrations