Geometry & MOs

Info

ID:	224536
PubChem CID:	85344629
Reduced:	N3O3H5C9 (1)
Stoich.:	A3B3C5D9 (1)
Weight, g/mol:	203.025229
ΔH_f, kcal/mol:	66.93
Dipole, Da:	8.52
IP(EA), eV:	-10.0(-2.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methylsulfonyl-3-azabicyclo[3.2.0]heptane-2,4-dione

Drug info:

PubChemData

Smile

C1=CC2C(=C3C(=NOC3=O)N=[N+]2[O-])C=C1

DOS

IR

Vibrations