Geometry & MOs

Info

ID:	282025
PubChem CID:	103914676
Reduced:	F3N5C11H18 (1)
Stoich.:	A3B5C11D18 (1)
Weight, g/mol:	220.143645
ΔH_f, kcal/mol:	-121.74
Dipole, Da:	6.05
IP(EA), eV:	-9.09(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN1C=NC(=N1)CNC2CCN(CC2)CC(F)(F)F

DOS

IR

Vibrations