Geometry & MOs

Info

ID:	254701
PubChem CID:	103127048
Reduced:	F3N4H11C14 (1)
Stoich.:	A3B4C11D14 (1)
Weight, g/mol:	274.103003
ΔH_f, kcal/mol:	-54.6
Dipole, Da:	4.06
IP(EA), eV:	-9.43(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,4-difluorophenyl)-N-methyl-1-pyrazolo[1,5-a]pyrazin-3-ylmethanamine

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C(C2=C3C=NC=CN3N=C2)N)C(F)(F)F

DOS

IR

Vibrations