Geometry & MOs

Info

ID:	254635
PubChem CID:	103126644
Reduced:	ClFN3H15C16 (1)
Stoich.:	ABC3D15E16 (1)
Weight, g/mol:	290.073452
ΔH_f, kcal/mol:	29.61
Dipole, Da:	5.06
IP(EA), eV:	-8.8(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-chloro-4-fluorophenyl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations