Geometry & MOs

Info

ID:	376656
PubChem CID:	134222679
Reduced:	NSH19C29 (2)
Stoich.:	ABC19D29 (2)
Weight, g/mol:	532.287849
ΔH_f, kcal/mol:	258.11
Dipole, Da:	1.77
IP(EA), eV:	-7.92(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-1-N,1-N,4-N,4-N-tetrakis(3-methylphenyl)naphthalene-1,4-diamine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N(C2=CC=CC(=C2)C3=CC=CC4=C3SC5=CC=CC=C45)C6=CC=C(C7=CC=CC=C76)N(C8=CC=CC=C8)C9=CC=CC(=C9)C1=CC=CC2=C1SC1=CC=CC=C21

DOS

IR

Vibrations