Geometry & MOs

Info

ID:	449538
PubChem CID:	135299394
Reduced:	NH31C46 (1)
Stoich.:	AB31C46 (1)
Weight, g/mol:	647.2613
ΔH_f, kcal/mol:	187.75
Dipole, Da:	0.51
IP(EA), eV:	-7.95(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-bis(4-phenanthren-2-ylphenyl)naphthalen-1-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC(=CC=C3)N(C4=CC5=C(C=C4)C6=CC=CC=C6C=C5)C7=CC8=C(C=C7)C9=CC=CC=C9C=C8

DOS

IR

Vibrations