Geometry & MOs

Info

ID:

196871

PubChem CID:

78889148

Reduced:

O3C14H22 (1)

Stoich.:

A3B14C22 (1)

Weight, g/mol:

252.172545

ΔHf, kcal/mol:

-145.65

Dipole, Da:

0.58

IP(EA), eV:

-9.52(0.54)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

cyclohex-3-en-1-ylmethyl 2-cyclohexyloxyacetate

Drug info:

PubChemData

Smile

C1CCC(C1)OCC(=O)OCC2CCC=CC2

DOS

IR

Vibrations