Geometry & MOs

Info

ID:	254069
PubChem CID:	103122499
Reduced:	BrON3C13H14 (1)
Stoich.:	ABC3D13E14 (1)
Weight, g/mol:	321.04767
ΔH_f, kcal/mol:	14.63
Dipole, Da:	4.4
IP(EA), eV:	-9.22(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(bromomethyl)piperidin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone

Drug info:

PubChemData

Smile

C1CC(N(C1)C(=O)C2=C3C=CC=CN3N=C2)CBr

DOS

IR

Vibrations