Geometry & MOs

Info

ID:	289867
PubChem CID:	104380272
Reduced:	SN4O5C10H16 (1)
Stoich.:	AB4C5D10E16 (1)
Weight, g/mol:	327.071134
ΔH_f, kcal/mol:	-164.5
Dipole, Da:	6.38
IP(EA), eV:	-9.62(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5,6-dimethyl-4-oxo-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-3-yl)-N-(2-methoxyethyl)acetamide

Drug info:

PubChemData

Smile

COCCNC(=O)CN1C(=NN=C1SCC(=O)O)CO

DOS

IR

Vibrations