Geometry & MOs

Info

ID:

432765

PubChem CID:

135172902

Reduced:

N5O10C59H85 (1)

Stoich.:

A5B10C59D85 (1)

Weight, g/mol:

309.195346

ΔHf, kcal/mol:

-472.6

Dipole, Da:

2.76

IP(EA), eV:

 -8.89(-0.44)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-N-[1-[[4-(dimethylamino)phenyl]diazenyl]ethenyl]-1-N,2-N-dimethylbenzene-1,2-diamine

Drug info:

PubChemData

Smile

CC[C@H](C)[C@@H]([C@@H](CC(=O)N1[C@H](CC[C@H]1[C@@H]([C@@H](C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)OC(C)(C)C)OC)C)OC)N(C)C(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)N(C)C(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

DOS

IR

Vibrations