Geometry & MOs

Info

ID:	355317
PubChem CID:	127288294
Reduced:	ON4C19H22 (1)
Stoich.:	AB4C19D22 (1)
Weight, g/mol:	331.200825
ΔH_f, kcal/mol:	25.36
Dipole, Da:	3.96
IP(EA), eV:	-9.15(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)-N-(1-oxo-1-piperidin-1-ylpropan-2-yl)acetamide

Drug info:

PubChemData

Smile

C1CC(C1)(C2=CC=CC=C2)NC(=O)CN3CCC4=CN=CN=C4C3

DOS

IR

Vibrations