Geometry & MOs

Info

ID:	253762
PubChem CID:	103120442
Reduced:	ON6C12H12 (1)
Stoich.:	AB6C12D12 (1)
Weight, g/mol:	258.097757
ΔH_f, kcal/mol:	68.82
Dipole, Da:	1.81
IP(EA), eV:	-9.54(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(2H-tetrazol-5-yl)ethyl]pyrazolo[1,5-a]pyrazine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=NN1)CNC(=O)C2=C3C=NC=CN3N=C2

DOS

IR

Vibrations