Geometry & MOs

Info

ID:	67174
PubChem CID:	46506006
Reduced:	N3O5H13C19 (1)
Stoich.:	A3B5C13D19 (1)
Weight, g/mol:	372.072177
ΔH_f, kcal/mol:	-35.46
Dipole, Da:	6.72
IP(EA), eV:	-9.49(-2.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-2-[4-(trifluoromethoxy)phenyl]pyrrolo[3,4-c]quinoline-1,3-dione

Drug info:

PubChemData

Smile

CC1=NC2=CC=CC=C2C3=C1C(=O)N(C3=O)C4=C(C=C(C=C4)[N+](=O)[O-])OC

DOS

IR

Vibrations