Geometry & MOs

Info

ID:

318886

PubChem CID:

126653620

Reduced:

NSH16C23 (2)

Stoich.:

ABC16D23 (2)

Weight, g/mol:

776.231992

ΔHf, kcal/mol:

212.52

Dipole, Da:

0.57

IP(EA), eV:

 -8.03(-0.93)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[4-[2-[4-(N-naphthalen-1-ylanilino)phenyl]thieno[2,3-f][1]benzothiol-6-yl]phenyl]-N-phenylnaphthalen-1-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=C(C=C3)C4=CC5=CC6=C(C=C(S6)C7=CC=C(C=C7)N(C8=CC=CC=C8)C9=CC=CC=C9)C=C5S4

DOS

IR

Vibrations