Geometry & MOs

Info

ID:	252409
PubChem CID:	103111174
Reduced:	ON2C4H7 (2)
Stoich.:	AB2C4D7 (2)
Weight, g/mol:	260.079707
ΔH_f, kcal/mol:	-41.26
Dipole, Da:	3.9
IP(EA), eV:	-10.08(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-1-[(2-methyl-3-nitrophenyl)methyl]pyrrole-2,5-dione

Drug info:

PubChemData

Smile

CCN1C(=C(N=N1)C(=O)OCC)CN

DOS

IR

Vibrations