Geometry & MOs

Info

ID:

216323

PubChem CID:

85086048

Reduced:

ON4C14H16 (1)

Stoich.:

AB4C14D16 (1)

Weight, g/mol:

254.131823

ΔHf, kcal/mol:

34.66

Dipole, Da:

3.6

IP(EA), eV:

-8.89(-0.46)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

4-fluoro-5-methyl-3-phenylmethoxycyclohexane-1,2-diol

Drug info:

PubChemData

Smile

C1=CC=C2C=C(C=CC2=C1)CC3C(NNC3=O)NN

DOS

IR

Vibrations