Geometry & MOs

Info

ID:	19533
PubChem CID:	566929
Reduced:	N2C5H10 (2)
Stoich.:	A2B5C10 (2)
Weight, g/mol:	196.168797
ΔH_f, kcal/mol:	11.75
Dipole, Da:	2.72
IP(EA), eV:	-8.92(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-octyl-1H-1,2,4-triazol-3-amine

Drug info:

PubChemData

Smile

CCCCCCCCC1=NC(=NN1)N

DOS

IR

Vibrations