Geometry & MOs

Info

ID:	382970
PubChem CID:	134974428
Reduced:	SN4O7C36H46 (1)
Stoich.:	AB4C7D36E46 (1)
Weight, g/mol:	329.1223
ΔH_f, kcal/mol:	-263.31
Dipole, Da:	2.83
IP(EA), eV:	-8.79(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3S,6S)-4,5-diacetyloxy-6-azido-3-methyloxan-2-yl]methyl acetate

Drug info:

PubChemData

Smile

C[C@H]1C(C([C@@H](C(O1)SCC2=CN(N=N2)C[C@H](CC(=O)OC(C)(C)C)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35)OC(=O)C)C)C

DOS

IR

Vibrations