Geometry & MOs

Info

ID:	332886
PubChem CID:	127251310
Reduced:	O3N4C19H24 (1)
Stoich.:	A3B4C19D24 (1)
Weight, g/mol:	417.18009
ΔH_f, kcal/mol:	-115.52
Dipole, Da:	1.97
IP(EA), eV:	-9.44(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[1-[2-(1H-indol-3-yl)acetyl]pyrrolidin-3-yl]-1,3-dimethylpyrido[2,3-d]pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CN1C2=C(C=CC(=N2)C3CCN(C3)C(=O)C4CCCC4)C(=O)N(C1=O)C

DOS

IR

Vibrations