Geometry & MOs

Info

ID:

219441

PubChem CID:

85148672

Reduced:

N3O8C26H27 (1)

Stoich.:

A3B8C26D27 (1)

Weight, g/mol:

512.10773

ΔHf, kcal/mol:

-243.82

Dipole, Da:

2.79

IP(EA), eV:

-8.3(-0.92)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

acetic acid;(4-methoxyphenyl)-phenyllead

Drug info:

PubChemData

Smile

CC1=CN(C2=CC(=C3C(=C12)C(C(N3)(C)C(=O)OC)O)O)C(=O)C4=CC5=CC(=C(C(=C5N4)OC)OC)OC

DOS

IR

Vibrations