Geometry & MOs

Info

ID:

332885

PubChem CID:

127251309

Reduced:

FO3N4C21H21 (1)

Stoich.:

AB3C4D21E21 (1)

Weight, g/mol:

356.184841

ΔHf, kcal/mol:

-127.52

Dipole, Da:

3.16

IP(EA), eV:

-9.62(-1.24)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

7-[1-(cyclopentanecarbonyl)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)CC4=CC=C(C=C4)F)C(=O)N(C1=O)C

DOS

IR

Vibrations