Geometry & MOs

Info

ID:	254052
PubChem CID:	103122405
Reduced:	ClON3C13H14 (1)
Stoich.:	ABC3D13E14 (1)
Weight, g/mol:	249.06689
ΔH_f, kcal/mol:	5.42
Dipole, Da:	5.87
IP(EA), eV:	-8.88(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-chloropyrrolidin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2C(=N1)C(=O)N3CCC(C3)Cl

DOS

IR

Vibrations