Geometry & MOs

Info

ID:

180458

PubChem CID:

76636496

Reduced:

CoN3O6C34H43 (1)

Stoich.:

AB3C6D34E43 (1)

Weight, g/mol:

530.185386

ΔHf, kcal/mol:

-187.12

Dipole, Da:

11.05

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 2.070766

Charge, e:

 0

Chem-info

IUPAC name:

2-(3-benzyl-1-ethyl-5-methoxy-3-methylindol-2-ylidene)ethanimine;cobalt;2-methoxybenzamide

Drug info:

PubChemData

Smile

CCN1C2=C(C=C(C=C2)OC)C(C1=CC=N)(C)CC3=CC=CC=C3.COCCOC1=C(C=C(C=C1)C(=O)N)OCCOC.[Co]

DOS

IR

Vibrations