Geometry & MOs

Info

ID:	349145
PubChem CID:	127274871
Reduced:	SN2O3C12H20 (1)
Stoich.:	AB2C3D12E20 (1)
Weight, g/mol:	396.074839
ΔH_f, kcal/mol:	-129.11
Dipole, Da:	7.36
IP(EA), eV:	-8.98(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetyl]-N,N-dimethyl-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CN(C)C(=O)C1CSCN1C(=O)C2CCOCC2

DOS

IR

Vibrations