Geometry & MOs

Info

ID:	364923
PubChem CID:	127316569
Reduced:	O2N3C15H25 (1)
Stoich.:	A2B3C15D25 (1)
Weight, g/mol:	374.177647
ΔH_f, kcal/mol:	-89.86
Dipole, Da:	3.84
IP(EA), eV:	-8.82(0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(4-cyclobutylpiperazin-1-yl)-3-oxopropyl]-5,6-dimethylthieno[2,3-d]pyrimidin-4-one

Drug info:

PubChemData

Smile

CN1CCC(CC1=O)C(=O)N2CCN(CC2)C3CCC3

DOS

IR

Vibrations