Geometry & MOs

Info

ID:

270363

PubChem CID:

103636254

Reduced:

F3O3C13H17 (1)

Stoich.:

A3B3C13D17 (1)

Weight, g/mol:

262.118064

ΔHf, kcal/mol:

-279.14

Dipole, Da:

6.24

IP(EA), eV:

-8.71(0.38)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-phenyl-5-(2,2,2-trifluoroethoxy)pentan-3-ol

Drug info:

PubChemData

Smile

COC1=CC=CC=C1CC(CCOCC(F)(F)F)O

DOS

IR

Vibrations