Geometry & MOs

Info

ID:	246756
PubChem CID:	103064816
Reduced:	OSN4C10H14 (1)
Stoich.:	ABC4D10E14 (1)
Weight, g/mol:	214.023455
ΔH_f, kcal/mol:	2.5
Dipole, Da:	3.45
IP(EA), eV:	-8.71(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-sulfanylidene-1-(thiolan-3-yl)pyrimidin-4-one

Drug info:

PubChemData

Smile

C1CSCC1NC(=O)C2=NC=CC(=C2)NN

DOS

IR

Vibrations