Geometry & MOs

Info

ID:

260854

PubChem CID:

103207031

Reduced:

F2O2N3C6H9 (1)

Stoich.:

A2B2C3D6E9 (1)

Weight, g/mol:

296.99761

ΔHf, kcal/mol:

-136.41

Dipole, Da:

4.12

IP(EA), eV:

-9.66(-0.33)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-(4-bromophenyl)-2-(2,2,2-trifluoroethoxy)ethanamine

Drug info:

PubChemData

Smile

C(COCC(F)F)C1=NN=C(O1)N

DOS

IR

Vibrations