Geometry & MOs

Info

ID:	435514
PubChem CID:	135191681
Reduced:	NH19C21 (1)
Stoich.:	AB19C21 (1)
Weight, g/mol:	602.272199
ΔH_f, kcal/mol:	75.62
Dipole, Da:	2.03
IP(EA), eV:	-8.02(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylbicyclo[4.4.1]undeca-1(10),2,4,6,8-pentaen-2-amine

Drug info:

PubChemData

Smile

CN(C1CC2=CC=CC=C2C=C1)C3=CC4=CC=CC=C4C=C3

DOS

IR

Vibrations