Geometry & MOs

Info

ID:

323847

PubChem CID:

126676318

Reduced:

N10C19H22 (1)

Stoich.:

A10B19C22 (1)

Weight, g/mol:

243.089543

ΔHf, kcal/mol:

172.06

Dipole, Da:

3.47

IP(EA), eV:

-8.23(-0.34)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

methyl 2-prop-2-enoxyquinoline-6-carboxylate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CN2C=C(N=N2)CN3C=C(C=N3)CC4=CC(=NC(=C4N)NN)N

DOS

IR

Vibrations