Geometry & MOs

Info

ID:	131918
PubChem CID:	51279824
Reduced:	O3N5H19C21 (1)
Stoich.:	A3B5C19D21 (1)
Weight, g/mol:	343.081305
ΔH_f, kcal/mol:	-35.9
Dipole, Da:	2.44
IP(EA), eV:	-9.02(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-N-phenyl-2-thieno[3,2-d]pyrimidin-4-ylsulfanylpropanamide

Drug info:

PubChemData

Smile

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)C(C3=CC=CC=C3)C(=O)NC4=CC=CC=C4

DOS

IR

Vibrations