Geometry & MOs

Info

ID:	2856
PubChem CID:	8744
Reduced:	ClNO3C9H14 (1)
Stoich.:	ABC3D9E14 (1)
Weight, g/mol:	219.066221
ΔH_f, kcal/mol:	-151.55
Dipole, Da:	1.08
IP(EA), eV:	-9.06(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-amino-1-hydroxypropyl)benzene-1,2-diol;hydrochloride

Drug info:

PubChemData

Smile

CC(C(C1=CC(=C(C=C1)O)O)O)N.Cl

DOS

IR

Vibrations