Geometry & MOs

Info

ID:	29749
PubChem CID:	836872
Reduced:	NSO4C15H15 (1)
Stoich.:	ABC4D15E15 (1)
Weight, g/mol:	304.017018
ΔH_f, kcal/mol:	-115.39
Dipole, Da:	4.3
IP(EA), eV:	-9.81(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-3-(2-chlorophenyl)-2-methylquinazolin-4-one

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC(=CC=C1)NS(=O)(=O)C2=CC=CC=C2

DOS

IR

Vibrations