Geometry & MOs

Info

ID:	1132
PubChem CID:	3829
Reduced:	NO3C4H6 (2)
Stoich.:	AB3C4D6 (2)
Weight, g/mol:	232.069536
ΔH_f, kcal/mol:	-246.05
Dipole, Da:	6.59
IP(EA), eV:	-10.38(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6,7,8-trihydroxy-5-(hydroxymethyl)-1,5,6,7,8,8a-hexahydroimidazo[1,2-a]pyridine-2,3-dione

Drug info:

PubChemData

Smile

C(C1C(C(C(C2N1C(=O)C(=O)N2)O)O)O)O

DOS

IR

Vibrations