Geometry & MOs

Info

ID:	286284
PubChem CID:	104169988
Reduced:	ON4C10H18 (1)
Stoich.:	AB4C10D18 (1)
Weight, g/mol:	226.179361
ΔH_f, kcal/mol:	15.11
Dipole, Da:	6.38
IP(EA), eV:	-8.88(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(2-methoxypropyl)-1,2,4-triazol-3-yl]methyl]-2-methylpropan-2-amine

Drug info:

PubChemData

Smile

CC(CN1C=NC(=N1)CNC2CC2)OC

DOS

IR

Vibrations