Geometry & MOs

Info

ID:	355313
PubChem CID:	127288290
Reduced:	ON5C20H21 (1)
Stoich.:	AB5C20D21 (1)
Weight, g/mol:	317.185175
ΔH_f, kcal/mol:	38.34
Dipole, Da:	7.54
IP(EA), eV:	-8.54(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(cyclopropylamino)-2-oxoethyl]-2-(6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)-N-methylpropanamide

Drug info:

PubChemData

Smile

C1CN(CC2=NC=NC=C21)CC(=O)N3CCC4=C(C3)C5=CC=CC=C5N4

DOS

IR

Vibrations