Geometry & MOs

Info

ID:

201244

PubChem CID:

79511324

Reduced:

FN2O2C15H19 (1)

Stoich.:

AB2C2D15E19 (1)

Weight, g/mol:

279.072928

ΔHf, kcal/mol:

-109.52

Dipole, Da:

7.34

IP(EA), eV:

-8.79(-0.44)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-fluoro-6-(1-thiophen-2-ylpropan-2-ylamino)benzoic acid

Drug info:

PubChemData

Smile

C1CC2CN(CCCN2C1)C3=C(C(=CC=C3)F)C(=O)O

DOS

IR

Vibrations