Geometry & MOs

Info

ID:	375188
PubChem CID:	131472802
Reduced:	BrSO3H7C10 (1)
Stoich.:	ABC3D7E10 (1)
Weight, g/mol:	219.162314
ΔH_f, kcal/mol:	-91.78
Dipole, Da:	5.33
IP(EA), eV:	-9.33(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-5-[(2-methylpropan-2-yl)oxy]-1,2,3,4-tetrahydronaphthalen-1-amine

Drug info:

PubChemData

Smile

C1=CC2=C(C=C(S2)O)C(=C1CC(=O)O)Br

DOS

IR

Vibrations