Geometry & MOs

Info

ID:	200355
PubChem CID:	79376476
Reduced:	N3O3C11H17 (1)
Stoich.:	A3B3C11D17 (1)
Weight, g/mol:	245.116427
ΔH_f, kcal/mol:	-115.53
Dipole, Da:	1.38
IP(EA), eV:	-9.29(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-6-methyl-3-[(6-methylpyridin-2-yl)methyl]pyrimidin-4-one

Drug info:

PubChemData

Smile

CC1=CC(=O)N(C(=N1)OC)CCC(=O)N(C)C

DOS

IR

Vibrations