Geometry & MOs

Info

ID:	130992
PubChem CID:	51140526
Reduced:	N3O3S3C15H17 (1)
Stoich.:	A3B3C3D15E17 (1)
Weight, g/mol:	370.005046
ΔH_f, kcal/mol:	-41.28
Dipole, Da:	1.3
IP(EA), eV:	-8.73(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,6-dimethyl-2-[1-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethyl]-3H-thieno[2,3-d]pyrimidin-4-one

Drug info:

PubChemData

Smile

CCOC(=O)CN(C1=CC=CC=C1)C(=O)CSC2=NN=C(S2)SC

DOS

IR

Vibrations