Geometry & MOs

Info

ID:	29291
PubChem CID:	832836
Reduced:	ON3C17H19 (1)
Stoich.:	AB3C17D19 (1)
Weight, g/mol:	318.032668
ΔH_f, kcal/mol:	19.55
Dipole, Da:	4.09
IP(EA), eV:	-8.75(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6,8-dichloro-2-methyl-3-(3-methylphenyl)quinazolin-4-one

Drug info:

PubChemData

Smile

CC(C)C(=NNC(=O)NC1=CC=CC=C1)C2=CC=CC=C2

DOS

IR

Vibrations