Geometry & MOs

Info

ID:	319744
PubChem CID:	126657154
Reduced:	NC13H23 (1)
Stoich.:	AB13C23 (1)
Weight, g/mol:	181.157898
ΔH_f, kcal/mol:	-16.52
Dipole, Da:	1.37
IP(EA), eV:	-8.47(1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-4-(2-methylpentan-2-yl)triazole

Drug info:

PubChemData

Smile

CC1CCC2C1C(=C)CC(N(C2)C)C

DOS

IR

Vibrations