Geometry & MOs

Info

ID:	333507
PubChem CID:	127252059
Reduced:	O3N4H24C26 (1)
Stoich.:	A3B4C24D26 (1)
Weight, g/mol:	382.144119
ΔH_f, kcal/mol:	-46.12
Dipole, Da:	1.72
IP(EA), eV:	-9.64(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN1C(=O)C2=C(N=C(C=C2)C3CCN(C3)C(=O)C4=CC=CC=C4)N(C1=O)CC5=CC=CC=C5

DOS

IR

Vibrations