Geometry & MOs

Info

ID:	80659
PubChem CID:	49835789
Reduced:	NO7C13H25 (1)
Stoich.:	AB7C13D25 (1)
Weight, g/mol:	405.109352
ΔH_f, kcal/mol:	-332.25
Dipole, Da:	4.93
IP(EA), eV:	-9.83(0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R,3S,4R,5R,6S)-5-acetamido-3,4,6-triacetyloxythian-2-yl]methyl acetate

Drug info:

PubChemData

Smile

CC(=O)N[C@H]([C@@H]1[C@H](OC(O1)(C)C)[C@@H](CO)O)C(OC)OC

DOS

IR

Vibrations