Geometry & MOs

Info

ID:	260008
PubChem CID:	103179093
Reduced:	NO3C12H25 (1)
Stoich.:	AB3C12D25 (1)
Weight, g/mol:	259.214744
ΔH_f, kcal/mol:	-156.42
Dipole, Da:	4.98
IP(EA), eV:	-9.36(1.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[2-(3-methoxypropoxy)ethylamino]methyl]-4-methylcyclohexan-1-ol

Drug info:

PubChemData

Smile

COCCCOCCNCC1(CCCC1)O

DOS

IR

Vibrations