Geometry & MOs

Info

ID:

389908

PubChem CID:

134995907

Reduced:

NO2F4C5H5 (1)

Stoich.:

AB2C4D5E5 (1)

Weight, g/mol:

164.100129

ΔHf, kcal/mol:

-212.12

Dipole, Da:

0.9

IP(EA), eV:

-11.57(-0.41)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

[(1R,2S)-2-fluoro-2-methylcyclobutyl]benzene

Drug info:

PubChemData

Smile

COC(=O)C1(CN1F)C(F)(F)F

DOS

IR

Vibrations