Geometry & MOs

Info

ID:	333523
PubChem CID:	127252075
Reduced:	N2O2C11H12 (2)
Stoich.:	A2B2C11D12 (2)
Weight, g/mol:	432.216141
ΔH_f, kcal/mol:	-120.96
Dipole, Da:	0.46
IP(EA), eV:	-8.86(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzyl-7-[1-(cyclopentanecarbonyl)pyrrolidin-3-yl]-3-methylpyrido[2,3-d]pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CN1C2=C(C=CC(=N2)C3CCN(C3)C(=O)CC4=CC=C(C=C4)OC)C(=O)N(C1=O)C

DOS

IR

Vibrations