Geometry & MOs

Info

ID:	333633
PubChem CID:	127252185
Reduced:	FN3O3H20C23 (1)
Stoich.:	AB3C3D20E23 (1)
Weight, g/mol:	444.23254
ΔH_f, kcal/mol:	-88.29
Dipole, Da:	3.86
IP(EA), eV:	-9.44(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-[(3-fluorophenyl)methyl]-4-methyl-2-[1-(2-phenylethyl)pyrrolidin-3-yl]-5,6-dihydropyrido[2,3-d]pyrimidin-7-one

Drug info:

PubChemData

Smile

C1COC(CN1C(=O)C2=CC=C(C=C2)F)C3=CC=CC(=N3)C4=CC(=CC=C4)C(=O)N

DOS

IR

Vibrations