Geometry & MOs

Info

ID:	307988
PubChem CID:	125311159
Reduced:	SO2N5C17H19 (1)
Stoich.:	AB2C5D17E19 (1)
Weight, g/mol:	292.088164
ΔH_f, kcal/mol:	-1.02
Dipole, Da:	8.92
IP(EA), eV:	-8.95(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(4-methoxyphenoxy)ethylsulfanyl]-6-methyl-5H-pyrimidin-4-one

Drug info:

PubChemData

Smile

C[C@H]1[C@H](N2C(=NC1=O)NN=C2SCC(=O)N3CCC4=CC=CC=C43)C

DOS

IR

Vibrations