Geometry & MOs

Info

ID:	28550
PubChem CID:	828310
Reduced:	FNOC16H16 (1)
Stoich.:	ABCD16E16 (1)
Weight, g/mol:	328.121178
ΔH_f, kcal/mol:	-63.75
Dipole, Da:	3.64
IP(EA), eV:	-8.8(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-hydroxyphenyl)-3-(3-methylphenyl)quinazolin-4-one

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)C)NC(=O)C2=CC=CC=C2F)C

DOS

IR

Vibrations