Geometry & MOs

Info

ID:	387550
PubChem CID:	134985810
Reduced:	NO3C12H15 (1)
Stoich.:	AB3C12D15 (1)
Weight, g/mol:	245.116427
ΔH_f, kcal/mol:	-59.61
Dipole, Da:	3.24
IP(EA), eV:	-8.28(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,5-dimethyl-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-c]pyrazole-4,6-dione

Drug info:

PubChemData

Smile

CC(=O)CC/[N+](=C/C1=CC=C(C=C1)OC)/[O-]

DOS

IR

Vibrations