Geometry & MOs

Info

ID:	401303
PubChem CID:	135050876
Reduced:	NOSnCl5H16C21 (1)
Stoich.:	ABCD5E16F21 (1)
Weight, g/mol:	298.123189
ΔH_f, kcal/mol:	-57.36
Dipole, Da:	11.2
IP(EA), eV:	-10.08(-1.84)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

N-(2-oxo-1,2-diphenylethyl)benzonitrilium

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C#[N+]C(C2=CC=CC=C2)C(=O)C3=CC=CC=C3.Cl[Sn-](Cl)(Cl)(Cl)Cl

DOS

IR

Vibrations