Geometry & MOs

Info

ID:	280008
PubChem CID:	103846320
Reduced:	NO3C11H15 (1)
Stoich.:	AB3C11D15 (1)
Weight, g/mol:	207.162314
ΔH_f, kcal/mol:	-117.59
Dipole, Da:	5.89
IP(EA), eV:	-8.8(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-aminophenyl)heptan-1-ol

Drug info:

PubChemData

Smile

CCCOC1=C(C=CC(=C1)N)C(=O)OC

DOS

IR

Vibrations