Geometry & MOs

Info

ID:

21620

PubChem CID:

589265

Reduced:

O3C23H46 (1)

Stoich.:

A3B23C46 (1)

Weight, g/mol:

370.344695

ΔHf, kcal/mol:

-230.84

Dipole, Da:

3.0

IP(EA), eV:

-9.84(0.79)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

methyl 4-methoxy-4,8,12,16-tetramethylheptadecanoate

Drug info:

PubChemData

Smile

CC(C)CCCC(C)CCCC(C)CCCC(C)(CCC(=O)OC)OC

DOS

IR

Vibrations