Geometry & MOs

Info

ID:	33384
PubChem CID:	7886197
Reduced:	SO2N3H19C23 (1)
Stoich.:	AB2C3D19E23 (1)
Weight, g/mol:	403.099063
ΔH_f, kcal/mol:	6.11
Dipole, Da:	2.94
IP(EA), eV:	-9.05(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-acetylphenyl)-2-(4-oxo-6-phenylthieno[2,3-d]pyrimidin-3-yl)acetamide

Drug info:

PubChemData

Smile

C1CN(CC2=CC=CC=C21)C(=O)CN3C=NC4=C(C3=O)C=C(S4)C5=CC=CC=C5

DOS

IR

Vibrations