Geometry & MOs

Info

ID:	411276
PubChem CID:	135084089
Reduced:	ON3H9C10 (1)
Stoich.:	AB3C9D10 (1)
Weight, g/mol:	633.238118
ΔH_f, kcal/mol:	35.37
Dipole, Da:	6.99
IP(EA), eV:	-9.59(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3S,6R)-5-acetamido-3-[(2S,5S)-3-acetamido-4,5-diacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxy-4-acetyloxy-6-aminooxan-2-yl]methyl acetate

Drug info:

PubChemData

Smile

CC(=O)C1=CN(C=C1)C2=NC=CC=N2

DOS

IR

Vibrations