Geometry & MOs

Info

ID:	33977
PubChem CID:	7889098
Reduced:	OS2N5H15C17 (1)
Stoich.:	AB2C5D15E17 (1)
Weight, g/mol:	367.135448
ΔH_f, kcal/mol:	97.22
Dipole, Da:	6.35
IP(EA), eV:	-8.67(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-3-(2-oxo-2-piperidin-1-ylethyl)-6-phenylthieno[2,3-d]pyrimidin-4-one

Drug info:

PubChemData

Smile

CC1=CC(=C(N1C2=NC=CS2)C)C(=O)CSC3=NN=C4N3C=CC=C4

DOS

IR

Vibrations