Geometry & MOs

Info

ID:	254079
PubChem CID:	103122560
Reduced:	ClON3C11H12 (1)
Stoich.:	ABC3D11E12 (1)
Weight, g/mol:	268.072703
ΔH_f, kcal/mol:	-2.22
Dipole, Da:	3.96
IP(EA), eV:	-9.31(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-chloroethoxy)ethyl]pyrazolo[1,5-a]pyrazine-3-carboxamide

Drug info:

PubChemData

Smile

CC(CNC(=O)C1=C2C=CC=CN2N=C1)Cl

DOS

IR

Vibrations