Geometry & MOs

Info

ID:	24472
PubChem CID:	610461
Reduced:	ON2H12C15 (1)
Stoich.:	AB2C12D15 (1)
Weight, g/mol:	236.094963
ΔH_f, kcal/mol:	27.06
Dipole, Da:	2.8
IP(EA), eV:	-8.77(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methyl-3-phenylpyrido[1,2-a]pyrimidin-4-one

Drug info:

PubChemData

Smile

CC1=CC=CC2=NC=C(C(=O)N12)C3=CC=CC=C3

DOS

IR

Vibrations