Geometry & MOs

Info

ID:	144985
PubChem CID:	53445564
Reduced:	FOSH9C11 (1)
Stoich.:	ABCD9E11 (1)
Weight, g/mol:	192.035734
ΔH_f, kcal/mol:	-47.7
Dipole, Da:	1.65
IP(EA), eV:	-8.83(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3-methylthiophen-2-yl)-1H-pyrimidin-2-one

Drug info:

PubChemData

Smile

CC1=CSC(=C1)C2=CC(=C(C=C2)O)F

DOS

IR

Vibrations