Geometry & MOs

Info

ID:	20458
PubChem CID:	584052
Reduced:	O2N3C10H11 (1)
Stoich.:	A2B3C10D11 (1)
Weight, g/mol:	205.085127
ΔH_f, kcal/mol:	-47.38
Dipole, Da:	6.86
IP(EA), eV:	-9.59(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-4,7-dimethyl-8H-pyrido[2,3-d]pyrimidin-5-one

Drug info:

PubChemData

Smile

CC1=CC(=O)C2=C(N=C(N=C2N1)OC)C

DOS

IR

Vibrations