Geometry & MOs

Info

ID:	191197
PubChem CID:	78117003
Reduced:	ON4C9H10 (2)
Stoich.:	AB4C9D10 (2)
Weight, g/mol:	418.02792
ΔH_f, kcal/mol:	16.97
Dipole, Da:	4.14
IP(EA), eV:	-8.64(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-oxo-1,2-benzoselenazol-2-yl)-N-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]acetamide

Drug info:

PubChemData

Smile

CCC(C(=O)N)NC1=CN=C(C(=N1)NC2=CN(N=C2)C3=CC=CC=C3)C(=O)N

DOS

IR

Vibrations