Geometry & MOs

Info

ID:	50140
PubChem CID:	12012647
Reduced:	N2O3C18H22 (1)
Stoich.:	A2B3C18D22 (1)
Weight, g/mol:	429.99611
ΔH_f, kcal/mol:	-32.71
Dipole, Da:	9.79
IP(EA), eV:	-9.0(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-chlorophenyl)-1-(4-oxo-1,3-thiazol-2-yl)-3-thiophen-2-yl-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6-dione

Drug info:

PubChemData

Smile

CC(C)(C)C(C(C1=CC=CC=C1)NC2=CC=C(C=C2)[N+](=O)[O-])O

DOS

IR

Vibrations