Geometry & MOs

Info

ID:

190307

PubChem CID:

77982717

Reduced:

FO2C17H20 (2)

Stoich.:

AB2C17D20 (2)

Weight, g/mol:

570.275708

ΔHf, kcal/mol:

-240.95

Dipole, Da:

4.16

IP(EA), eV:

 -8.96(-0.62)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3-[3-[[4-[5-(difluoromethyl)-2-fluorophenyl]-3-(2,2-dimethylcyclopentyl)phenyl]methoxy]-2-fluorophenyl]-4-methylhexanoic acid

Drug info:

PubChemData

Smile

CCCC(CC(=O)O)C1=C(C(=CC=C1)OCC2=CC(=C(C=C2)C3=C(C=CC(=C3)OC)F)C4CCCCC4(C)C)F

DOS

IR

Vibrations