Geometry & MOs

Info

ID:	431428
PubChem CID:	135171503
Reduced:	ClO2N3C10H10 (1)
Stoich.:	AB2C3D10E10 (1)
Weight, g/mol:	315.077454
ΔH_f, kcal/mol:	-43.78
Dipole, Da:	3.49
IP(EA), eV:	-9.59(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-chloro-6-methyl-2-(phenylmethoxymethyl)-1H-pyrido[2,3-d]pyrimidin-4-one

Drug info:

PubChemData

Smile

CC1=CC2=C(NC(=NC2=O)COC)N=C1Cl

DOS

IR

Vibrations