Geometry & MOs

Info

ID:	253341
PubChem CID:	103117847
Reduced:	OH7N7C11 (1)
Stoich.:	AB7C7D11 (1)
Weight, g/mol:	277.09636
ΔH_f, kcal/mol:	114.3
Dipole, Da:	5.93
IP(EA), eV:	-9.7(-1.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-cyanophenyl)-N-methylpyrazolo[1,5-a]pyrazine-3-carboxamide

Drug info:

PubChemData

Smile

C1=CN2C(=C(C=N2)C(=O)NC3=C(C=NN3)C#N)C=N1

DOS

IR

Vibrations