Geometry & MOs

Info

ID:	49145
PubChem CID:	11528759
Reduced:	FN2C14H17 (1)
Stoich.:	AB2C14D17 (1)
Weight, g/mol:	232.067034
ΔH_f, kcal/mol:	6.24
Dipole, Da:	1.32
IP(EA), eV:	-8.41(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methoxy-1-(4-methylphenyl)pyrimidine-2-thione

Drug info:

PubChemData

Smile

CN(C)C[C@H]1C[C@@H]1C2=CNC3=C2C=CC=C3F

DOS

IR

Vibrations