Geometry & MOs

Info

ID:	333722
PubChem CID:	127252274
Reduced:	ON2C13H16 (2)
Stoich.:	AB2C13D16 (2)
Weight, g/mol:	432.252526
ΔH_f, kcal/mol:	-51.49
Dipole, Da:	6.05
IP(EA), eV:	-9.26(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C2CCC(=O)N(C2=NC(=N1)C3CCN(C3)C(=O)C4CCC4)CCCC5=CC=CC=C5

DOS

IR

Vibrations