Geometry & MOs

Info

ID:	381742
PubChem CID:	134972560
Reduced:	O2H8C9 (3)
Stoich.:	A2B8C9 (3)
Weight, g/mol:	613.07098
ΔH_f, kcal/mol:	-146.68
Dipole, Da:	5.77
IP(EA), eV:	-9.44(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[(2R,3S,4S,5R)-5-azido-4-iodo-3-phenylmethoxyoxolan-2-yl]-2-benzoyloxyethyl] benzoate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CO[C@@H]2C=CO[C@@H]2C(COC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4

DOS

IR

Vibrations