Geometry & MOs

Info

ID:	376655
PubChem CID:	134222678
Reduced:	NH19C20 (2)
Stoich.:	AB19C20 (2)
Weight, g/mol:	826.247642
ΔH_f, kcal/mol:	99.53
Dipole, Da:	2.35
IP(EA), eV:	-7.85(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N,4-N-bis(3-dibenzothiophen-4-ylphenyl)-1-N,4-N-diphenylnaphthalene-1,4-diamine

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)N(C2=CC=CC(=C2)C)C3=C(C(=C(C4=CC=CC=C43)N(C5=CC=CC(=C5)C)C6=CC=CC(=C6)C)C)C

DOS

IR

Vibrations