Geometry & MOs

Info

ID:	33971
PubChem CID:	7889082
Reduced:	SO2N3C19H19 (1)
Stoich.:	AB2C3D19E19 (1)
Weight, g/mol:	403.135448
ΔH_f, kcal/mol:	-31.43
Dipole, Da:	3.86
IP(EA), eV:	-8.87(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-methyl-4-oxo-6-phenylthieno[2,3-d]pyrimidin-3-yl)-N-[(1S)-1-phenylethyl]acetamide

Drug info:

PubChemData

Smile

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)N3CCCC3)C4=CC=CC=C4

DOS

IR

Vibrations