Geometry & MOs

Info

ID:	254044
PubChem CID:	103122381
Reduced:	ClON3C11H16 (1)
Stoich.:	ABC3D11E16 (1)
Weight, g/mol:	292.109089
ΔH_f, kcal/mol:	-21.47
Dipole, Da:	7.59
IP(EA), eV:	-9.22(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2-chloroethyl)piperidin-1-yl]-pyrazolo[1,5-a]pyrazin-3-ylmethanone

Drug info:

PubChemData

Smile

CN1C=CC(=N1)C(=O)N2CCCC(C2)CCl

DOS

IR

Vibrations