Geometry & MOs

Info

ID:	396790
PubChem CID:	135029227
Reduced:	NH23C28 (1)
Stoich.:	AB23C28 (1)
Weight, g/mol:	404.165054
ΔH_f, kcal/mol:	156.06
Dipole, Da:	1.7
IP(EA), eV:	-8.27(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C[N+](CC2=CC=CC=C2)C3=CC=CC=C3C#CC4=CC=CC=C4

DOS

IR

Vibrations