Geometry & MOs

Info

ID:

377250

PubChem CID:

134223295

Reduced:

F4O5C22H30 (2)

Stoich.:

A4B5C22D30 (2)

Weight, g/mol:

638.366099

ΔHf, kcal/mol:

-873.05

Dipole, Da:

7.75

IP(EA), eV:

 -8.58(-0.21)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

9-N,10-N,10-N-tris(4-methylphenyl)-9-N-phenyl-2,6-di(propan-2-yl)anthracene-9,10-diamine

Drug info:

PubChemData

Smile

CCC1CC(CC(=C2OC(C(O2)COC(=O)C3(CC(CC(=C4OCC(C(CO4)(F)F)(F)F)C3)C)CC)COC(=O)C5(CC(CC(=C6OCC(C(CO6)(F)F)(F)F)C5)C)CC)C1)C

DOS

IR

Vibrations