Geometry & MOs

Info

ID:	187895
PubChem CID:	77639791
Reduced:	ClON5C20H26 (1)
Stoich.:	ABC5D20E26 (1)
Weight, g/mol:	293.12766
ΔH_f, kcal/mol:	-14.09
Dipole, Da:	4.04
IP(EA), eV:	-8.96(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-(3-pyridin-2-ylpyrazolidin-4-yl)pyrido[1,2-a]pyrimidin-4-one

Drug info:

PubChemData

Smile

C1COC2=C(C1NC(CCCN)CC3=NC4=CC=CC=C4N3)N=CC=C2.Cl

DOS

IR

Vibrations