Geometry & MOs

Info

ID:	253511
PubChem CID:	103118918
Reduced:	N2H4C5 (3)
Stoich.:	A2B4C5 (3)
Weight, g/mol:	280.139622
ΔH_f, kcal/mol:	141.38
Dipole, Da:	7.0
IP(EA), eV:	-8.67(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2-aminoethyl)-1-[(1-propyltetrazol-5-yl)methyl]triazole-4-carboxylic acid

Drug info:

PubChemData

Smile

C1=CC2=C(C=NN2C=C1)C3=C(C(=NN3)N)C4=CN=CC=C4

DOS

IR

Vibrations