Geometry & MOs

Info

ID:

298963

PubChem CID:

117664493

Reduced:

N3O5C15H21 (1)

Stoich.:

A3B5C15D21 (1)

Weight, g/mol:

329.126323

ΔHf, kcal/mol:

-164.45

Dipole, Da:

2.1

IP(EA), eV:

-9.72(-0.76)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

methyl 2,4-dimethoxy-6-[(E)-2-(6-methoxypyridin-2-yl)ethenyl]benzoate

Drug info:

PubChemData

Smile

CC(=CN1C(=O)N(C(=O)N(C1=O)C2C(O2)(C)C)C3C(O3)(C)C)C

DOS

IR

Vibrations