Geometry & MOs

Info

ID:

312921

PubChem CID:

126609959

Reduced:

O2C9H14 (2)

Stoich.:

A2B9C14 (2)

Weight, g/mol:

922.371698

ΔHf, kcal/mol:

-191.79

Dipole, Da:

3.13

IP(EA), eV:

 -9.03(0.0)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

methyl 2-[2-[[2-[[2-[[2-[[2-[[2-[[2-[(2-hydroxyphenyl)methoxy]phenyl]methoxy]phenyl]methoxy]phenyl]methoxy]phenyl]methoxy]phenyl]methoxy]phenyl]methoxy]phenyl]propanoate

Drug info:

PubChemData

Smile

CC[C@H]([C@H](C1=CC(=CC=C1)OCC2(CCCCCC2)O)O)O

DOS

IR

Vibrations