Geometry & MOs

Info

ID:	162723
PubChem CID:	57551949
Reduced:	SN3O8C12H19 (1)
Stoich.:	AB3C8D12E19 (1)
Weight, g/mol:	329.1223
ΔH_f, kcal/mol:	-289.3
Dipole, Da:	3.55
IP(EA), eV:	-10.05(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-2-[(3aR,5S,6S,6aR)-6-azido-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-2-acetyloxyethyl] acetate

Drug info:

PubChemData

Smile

CC(=O)OC[C@H]([C@@H]1[C@@H]([C@@H]2[C@H](O1)OC(O2)(C)C)N=[N+]=[N-])OS(=O)(=O)C

DOS

IR

Vibrations