Geometry & MOs

Info

ID:	323698
PubChem CID:	126675760
Reduced:	ClN8H11C12 (1)
Stoich.:	AB8C11D12 (1)
Weight, g/mol:	295.129391
ΔH_f, kcal/mol:	142.8
Dipole, Da:	4.1
IP(EA), eV:	-8.8(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[(5-phenyltetrazol-2-yl)methyl]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine

Drug info:

PubChemData

Smile

C1=CC2=C(C(=C1)Cl)N(N=N2)CC3=CC(=NC(=C3N=N)N)N

DOS

IR

Vibrations