Geometry & MOs

Info

ID:	397279
PubChem CID:	135029989
Reduced:	N4H12C17 (1)
Stoich.:	A4B12C17 (1)
Weight, g/mol:	332.059552
ΔH_f, kcal/mol:	138.82
Dipole, Da:	3.76
IP(EA), eV:	-9.11(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[1-[2-chloro-2-(4-chlorophenyl)propyl]triazol-4-yl]pyridine

Drug info:

PubChemData

Smile

C1=CC=C2C=C(C=CC2=C1)N3C=C(N=N3)C4=CN=CC=C4

DOS

IR

Vibrations