Geometry & MOs

Info

ID:	396784
PubChem CID:	135029218
Reduced:	OSF3H9C16 (1)
Stoich.:	ABC3D9E16 (1)
Weight, g/mol:	272.094963
ΔH_f, kcal/mol:	-132.22
Dipole, Da:	3.94
IP(EA), eV:	-9.18(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-phenylpyrido[2,1-b]quinazolin-11-one

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=O)C=C(S2)C3=CC=C(C=C3)C(F)(F)F

DOS

IR

Vibrations