Geometry & MOs

Info

ID:	396763
PubChem CID:	135029163
Reduced:	NO3H13C19 (1)
Stoich.:	AB3C13D19 (1)
Weight, g/mol:	268.040341
ΔH_f, kcal/mol:	-4.55
Dipole, Da:	7.07
IP(EA), eV:	-8.84(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-chloro-12H-isoindolo[1,2-b]quinazolin-10-one

Drug info:

PubChemData

Smile

CN1C=C(C2=CC=CC=C21)C(=O)C(=O)C3=CC4=CC=CC=C4O3

DOS

IR

Vibrations