Geometry & MOs

Info

ID:	20102
PubChem CID:	579319
Reduced:	NO2C12H19 (1)
Stoich.:	AB2C12D19 (1)
Weight, g/mol:	209.141579
ΔH_f, kcal/mol:	-87.37
Dipole, Da:	1.77
IP(EA), eV:	-8.68(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(6-aminohexyl)benzene-1,2-diol

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1CCCCCCN)O)O

DOS

IR

Vibrations