Geometry & MOs

Info

ID:	325612
PubChem CID:	126684168
Reduced:	N4C13H18 (1)
Stoich.:	A4B13C18 (1)
Weight, g/mol:	266.153147
ΔH_f, kcal/mol:	63.71
Dipole, Da:	4.27
IP(EA), eV:	-9.24(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[1-(2-methylbutyl)triazol-4-yl]quinoline

Drug info:

PubChemData

Smile

CCC(C)(C)CN1C=C(N=N1)C2=CN=CC=C2

DOS

IR

Vibrations