Geometry & MOs

Info

ID:	329472
PubChem CID:	126737205
Reduced:	N3C15H29 (1)
Stoich.:	A3B15C29 (1)
Weight, g/mol:	253.251798
ΔH_f, kcal/mol:	-6.58
Dipole, Da:	0.97
IP(EA), eV:	-9.96(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(5-methyldodecan-5-yl)-2,3-dihydro-1H-1,2,4-triazole

Drug info:

PubChemData

Smile

CCCCCCCC(C)(CCCC)C1=NNN=C1

DOS

IR

Vibrations