Geometry & MOs

Info

ID:	206326
PubChem CID:	80232250
Reduced:	NSC15H19 (1)
Stoich.:	ABC15D19 (1)
Weight, g/mol:	285.94116
ΔH_f, kcal/mol:	33.46
Dipole, Da:	1.96
IP(EA), eV:	-8.65(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-4-hydroxy-2-(4-methylthiophen-3-yl)-1H-pyrimidin-6-one

Drug info:

PubChemData

Smile

CCNC(C1=CC=CC=C1C)C2=CSC=C2C

DOS

IR

Vibrations