Geometry & MOs

Info

ID:

323605

PubChem CID:

126675569

Reduced:

N8C15H22 (1)

Stoich.:

A8B15C22 (1)

Weight, g/mol:

379.223292

ΔHf, kcal/mol:

96.62

Dipole, Da:

4.44

IP(EA), eV:

-8.32(0.17)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

4-[(Z)-3-amino-2-[(1-ethylbenzimidazol-2-yl)methyliminomethyl]prop-2-enyl]-6-hydrazinylpyridine-2,5-diamine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CN(/C=C(/CC2=CC(=NC(=C2N)NN)N)\N)N

DOS

IR

Vibrations