Geometry & MOs

Info

ID:	56439
PubChem CID:	17425465
Reduced:	ClFSN3O3C16H17 (1)
Stoich.:	ABCD3E3F16G17 (1)
Weight, g/mol:	350.006281
ΔH_f, kcal/mol:	-149.53
Dipole, Da:	1.6
IP(EA), eV:	-9.37(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-chloropyridin-2-yl)-2-thieno[3,2-d]pyrimidin-4-ylsulfanylpropanamide

Drug info:

PubChemData

Smile

CC1=C(C(=O)N=C(N1)SC(C)C(=O)NC2=CC(=C(C=C2)F)Cl)CCO

DOS

IR

Vibrations