Geometry & MOs

Info

ID:

325057

PubChem CID:

126679414

Reduced:

NC4H5 (2)

Stoich.:

AB4C5 (2)

Weight, g/mol:

1067.180563

ΔHf, kcal/mol:

33.3

Dipole, Da:

3.45

IP(EA), eV:

-8.17(0.37)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

6-(butylamino)-4-hydroxy-3-[2-[4-[2-[4-[2-[4-(2-prop-2-enoyloxyethoxy)phenyl]hydrazinyl]-7-sulfonaphthalen-1-yl]hydrazinyl]-7-sulfonaphthalen-1-yl]hydrazinyl]naphthalene-2,7-disulfonic acid

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)/C=C\N)N

DOS

IR

Vibrations