Geometry & MOs

Info

ID:	24918
PubChem CID:	614486
Reduced:	SN2O5C17H18 (1)
Stoich.:	AB2C5D17E18 (1)
Weight, g/mol:	362.093643
ΔH_f, kcal/mol:	-148.88
Dipole, Da:	2.51
IP(EA), eV:	-8.23(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 7-(2,5-dimethoxyphenyl)-5-methyl-3-oxo-7H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Drug info:

PubChemData

Smile

CC1=C(C(N=C2N1C(=O)CS2)C3=C(C=CC(=C3)OC)OC)C(=O)OC

DOS

IR

Vibrations