Geometry & MOs

Info

ID:	341508
PubChem CID:	127264201
Reduced:	ClNF2C6H10 (1)
Stoich.:	ABC2D6E10 (1)
Weight, g/mol:	260.99199
ΔH_f, kcal/mol:	-134.0
Dipole, Da:	4.33
IP(EA), eV:	-9.41(1.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-3,3-dimethyl-1,2-dihydroisoindole;hydrochloride

Drug info:

PubChemData

Smile

C1C2CC(C1NC2)(F)F.Cl

DOS

IR

Vibrations