Geometry & MOs

Info

ID:	254055
PubChem CID:	103122431
Reduced:	ClON4C14H15 (1)
Stoich.:	ABC4D14E15 (1)
Weight, g/mol:	289.09819
ΔH_f, kcal/mol:	108.44
Dipole, Da:	5.89
IP(EA), eV:	-9.34(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-chloro-8-azabicyclo[3.2.1]octan-8-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone

Drug info:

PubChemData

Smile

C1CC2CC(CC1N2C(=O)C3=C4C=NC=CN4N=C3)Cl

DOS

IR

Vibrations