Geometry & MOs

Info

ID:	355708
PubChem CID:	127289781
Reduced:	ON6C19H24 (1)
Stoich.:	AB6C19D24 (1)
Weight, g/mol:	365.185175
ΔH_f, kcal/mol:	31.45
Dipole, Da:	3.31
IP(EA), eV:	-8.77(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)-N-[3-(2-oxopyrrolidin-1-yl)phenyl]propanamide

Drug info:

PubChemData

Smile

C1CN(CC2=NC=NC=C21)CCC(=O)N3CCN(CC3)C4=CC=CC=N4

DOS

IR

Vibrations