Geometry & MOs

Info

ID:	277023
PubChem CID:	103826311
Reduced:	NOSC16H21 (1)
Stoich.:	ABCD16E21 (1)
Weight, g/mol:	259.157229
ΔH_f, kcal/mol:	-12.16
Dipole, Da:	1.27
IP(EA), eV:	-8.55(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(1-benzofuran-3-ylmethylamino)methyl]cyclohexan-1-ol

Drug info:

PubChemData

Smile

CSC1CCCCC1NCC2=COC3=CC=CC=C32

DOS

IR

Vibrations