Geometry & MOs

Info

ID:	253136
PubChem CID:	103116267
Reduced:	BrON4H11C14 (1)
Stoich.:	ABC4D11E14 (1)
Weight, g/mol:	271.086938
ΔH_f, kcal/mol:	41.94
Dipole, Da:	3.55
IP(EA), eV:	-8.48(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-amino-5-fluorophenyl)pyrazolo[1,5-a]pyrazine-3-carboxamide

Drug info:

PubChemData

Smile

C1=CC2=C(C=NN2C=C1)C(=O)NC3=C(C=CC(=C3)N)Br

DOS

IR

Vibrations