Geometry & MOs

Info

ID:	325603
PubChem CID:	126684149
Reduced:	N4C13H26 (1)
Stoich.:	A4B13C26 (1)
Weight, g/mol:	256.143645
ΔH_f, kcal/mol:	12.62
Dipole, Da:	6.15
IP(EA), eV:	-9.08(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[1-(2-methylpropyl)triazol-4-yl]methyl]benzotriazole

Drug info:

PubChemData

Smile

CCCCCCC(C)CN1C=C(N=N1)CNC

DOS

IR

Vibrations