Geometry & MOs

Info

ID:	254759
PubChem CID:	103127453
Reduced:	ClN4C15H15 (1)
Stoich.:	AB4C15D15 (1)
Weight, g/mol:	287.093773
ΔH_f, kcal/mol:	84.41
Dipole, Da:	3.97
IP(EA), eV:	-8.86(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-chloropyridin-4-yl)-N-methyl-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine

Drug info:

PubChemData

Smile

CNC(CC1=C(C=NC=C1)Cl)C2=C3C=CC=CN3N=C2

DOS

IR

Vibrations