Geometry & MOs

Info

ID:	254274
PubChem CID:	103123877
Reduced:	ClON4H11C14 (1)
Stoich.:	ABC4D11E14 (1)
Weight, g/mol:	274.036987
ΔH_f, kcal/mol:	50.27
Dipole, Da:	6.08
IP(EA), eV:	-9.1(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-chloropyrimidin-4-yl)pyrazolo[1,5-a]pyrazine-3-carboxamide

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2C(=N1)C(=O)NC3=NC=CC(=C3)Cl

DOS

IR

Vibrations