Geometry & MOs

Info

ID:

19603

PubChem CID:

568879

Reduced:

O3C18H32 (1)

Stoich.:

A3B18C32 (1)

Weight, g/mol:

296.235145

ΔHf, kcal/mol:

-133.08

Dipole, Da:

1.58

IP(EA), eV:

-10.0(0.52)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

methyl 2-methoxyhexadec-4-ynoate

Drug info:

PubChemData

Smile

CCCCCCCCCCCC#CCC(C(=O)OC)OC

DOS

IR

Vibrations