Geometry & MOs

Info

ID:	225212
PubChem CID:	85747953
Reduced:	BrNOSeC14H18 (1)
Stoich.:	ABCDE14F18 (1)
Weight, g/mol:	296.05536
ΔH_f, kcal/mol:	105.34
Dipole, Da:	17.98
IP(EA), eV:	-6.95(-2.49)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

2-hydroxy-8-phenylselanyl-2-azoniabicyclo[3.3.1]non-2-ene

Drug info:

PubChemData

Smile

C1CC(C2CC1CC=[N+]2O)[Se]C3=CC=CC=C3.[Br-]

DOS

IR

Vibrations