Geometry & MOs

Info

ID:

204955

PubChem CID:

80035998

Reduced:

NO2F4C14H17 (1)

Stoich.:

AB2C4D14E17 (1)

Weight, g/mol:

337.988833

ΔHf, kcal/mol:

-285.53

Dipole, Da:

5.72

IP(EA), eV:

-10.03(-1.09)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(3,4-dichlorophenyl)-[2-fluoro-3-(trifluoromethyl)phenyl]methanol

Drug info:

PubChemData

Smile

CCCC(COC)NC(=O)C1=C(C(=CC=C1)C(F)(F)F)F

DOS

IR

Vibrations