Geometry & MOs

Info

ID:	200349
PubChem CID:	79376470
Reduced:	N2O3C11H18 (1)
Stoich.:	A2B3C11D18 (1)
Weight, g/mol:	294.07712
ΔH_f, kcal/mol:	-139.21
Dipole, Da:	3.4
IP(EA), eV:	-9.6(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(5-chloro-2-methoxyphenyl)methyl]-2-methoxy-6-methylpyrimidin-4-one

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations