Geometry & MOs

Info

ID:	333694
PubChem CID:	127252246
Reduced:	FO2N5H24C25 (1)
Stoich.:	AB2C5D24E25 (1)
Weight, g/mol:	433.247775
ΔH_f, kcal/mol:	-50.71
Dipole, Da:	5.72
IP(EA), eV:	-9.55(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C2CCC(=O)N(C2=NC(=N1)C3CCN(C3)C(=O)C4=CN=CC=C4)CC5=CC(=CC=C5)F

DOS

IR

Vibrations