Geometry & MOs

Info

ID:	413347
PubChem CID:	135086295
Reduced:	NC8H14 (2)
Stoich.:	AB8C14 (2)
Weight, g/mol:	437.87261
ΔH_f, kcal/mol:	-14.24
Dipole, Da:	1.71
IP(EA), eV:	-7.75(1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-diiodo-6-methyl-1-phenylpyrazin-2-one

Drug info:

PubChemData

Smile

C1CCN(CC1)[C@H]2CCCC=C2N3CCCCC3

DOS

IR

Vibrations