Geometry & MOs

Info

ID:	374224
PubChem CID:	131325600
Reduced:	BrON2C11H13 (1)
Stoich.:	ABC2D11E13 (1)
Weight, g/mol:	288.01235
ΔH_f, kcal/mol:	-33.22
Dipole, Da:	4.17
IP(EA), eV:	-9.52(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-7-iodo-1,2,3,4-tetrahydronaphthalene-2,6-diamine

Drug info:

PubChemData

Smile

C1CC2=C(C[C@@H]1N)C=C(C=C2C(=O)N)Br

DOS

IR

Vibrations