Geometry & MOs

Info

ID:	191198
PubChem CID:	78117010
Reduced:	SeN2O7C15H18 (1)
Stoich.:	AB2C7D15E18 (1)
Weight, g/mol:	586.07018
ΔH_f, kcal/mol:	-262.78
Dipole, Da:	5.37
IP(EA), eV:	-8.8(-1.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3,4,5-triacetyloxy-6-[[2-(3-oxo-1,2-benzoselenazol-2-yl)acetyl]amino]oxan-2-yl]methyl acetate

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=O)N([Se]2)CC(=O)NC3C(C(C(C(O3)CO)O)O)O

DOS

IR

Vibrations