Geometry & MOs

Info

ID:

403095

PubChem CID:

135058720

Reduced:

ClFOH10C14 (1)

Stoich.:

ABCD10E14 (1)

Weight, g/mol:

231.92906

ΔHf, kcal/mol:

-24.3

Dipole, Da:

0.74

IP(EA), eV:

-9.11(-0.48)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

3-[(Z)-2-bromo-1-chloroethenyl]phenol

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)O/C(=C\Cl)/C2=CC=C(C=C2)F

DOS

IR

Vibrations