Geometry & MOs

Info

ID:	254839
PubChem CID:	103128069
Reduced:	ON6C12H12 (1)
Stoich.:	AB6C12D12 (1)
Weight, g/mol:	304.089102
ΔH_f, kcal/mol:	85.38
Dipole, Da:	1.77
IP(EA), eV:	-9.2(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=NC=CN=C1C(C2=C3C=NC=CN3N=C2)N

DOS

IR

Vibrations