Geometry & MOs

Info

ID:	372509
PubChem CID:	131298966
Reduced:	ClNO2C11H14 (1)
Stoich.:	ABC2D11E14 (1)
Weight, g/mol:	207.125929
ΔH_f, kcal/mol:	-91.82
Dipole, Da:	3.13
IP(EA), eV:	-9.24(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-amino-8-(hydroxymethyl)-1-methyl-6,7-dihydro-5H-naphthalen-2-ol

Drug info:

PubChemData

Smile

C1CC2=C(C=C(C=C2O)Cl)C(C1)(CO)N

DOS

IR

Vibrations