Geometry & MOs

Info

ID:	281410
PubChem CID:	103913828
Reduced:	SO2N4C10H20 (1)
Stoich.:	AB2C4D10E20 (1)
Weight, g/mol:	234.159295
ΔH_f, kcal/mol:	-57.04
Dipole, Da:	8.83
IP(EA), eV:	-9.84(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]-1-(1-methylimidazol-2-yl)ethanamine

Drug info:

PubChemData

Smile

CCN1C=NN=C1CNC(C)CS(=O)(=O)CC

DOS

IR

Vibrations