Geometry & MOs

Info

ID:	366375
PubChem CID:	127319856
Reduced:	O2N5C16H17 (1)
Stoich.:	A2B5C16D17 (1)
Weight, g/mol:	329.094646
ΔH_f, kcal/mol:	-11.95
Dipole, Da:	4.71
IP(EA), eV:	-8.81(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-3-oxopropyl]thieno[2,3-d]pyrimidin-4-one

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2N(C1=O)CC(=O)N3CCN4C=CN=C4C3

DOS

IR

Vibrations