Geometry & MOs

Info

ID:	200263
PubChem CID:	79374893
Reduced:	ON2C7H9 (2)
Stoich.:	AB2C7D9 (2)
Weight, g/mol:	260.127326
ΔH_f, kcal/mol:	-45.09
Dipole, Da:	3.89
IP(EA), eV:	-8.5(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCNC1=NC=C(C=C1)CN2C(=O)C=C(N=C2OC)C

DOS

IR

Vibrations