Geometry & MOs

Info

ID:

338398

PubChem CID:

127259090

Reduced:

O5C12H16 (1)

Stoich.:

A5B12C16 (1)

Weight, g/mol:

296.972626

ΔHf, kcal/mol:

-187.76

Dipole, Da:

1.1

IP(EA), eV:

-8.28(0.17)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-(3,5,6-trichloropyridin-2-yl)oxypropan-2-yl acetate

Drug info:

PubChemData

Smile

CC(=O)OCOCC1=CC(=C(C=C1)OC)OC

DOS

IR

Vibrations