Geometry & MOs

Info

ID:	253677
PubChem CID:	103119971
Reduced:	N7C9H9 (1)
Stoich.:	A7B9C9 (1)
Weight, g/mol:	279.075625
ΔH_f, kcal/mol:	146.76
Dipole, Da:	12.18
IP(EA), eV:	-8.16(-1.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-pyrazolo[1,5-a]pyrazin-3-yl-3H-benzimidazole-5-carboxylic acid

Drug info:

PubChemData

Smile

CN1C=C/C(=C/2\N=C3C(=NC=NC3=N2)N)/N1

DOS

IR

Vibrations