Geometry & MOs

Info

ID:	39569
PubChem CID:	8141399
Reduced:	S2N3O3H15C19 (1)
Stoich.:	A2B3C3D15E19 (1)
Weight, g/mol:	410.050733
ΔH_f, kcal/mol:	1.03
Dipole, Da:	3.29
IP(EA), eV:	-8.83(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-acetamido-N-(4-oxo-5-thiophen-2-ylthieno[2,3-d]pyrimidin-3-yl)benzamide

Drug info:

PubChemData

Smile

C[C@H](C(=O)NN1C=NC2=C(C1=O)C(=CS2)C3=CC=CS3)OC4=CC=CC=C4

DOS

IR

Vibrations