Geometry & MOs

Info

ID:	379336
PubChem CID:	134358604
Reduced:	OF2C24H28 (1)
Stoich.:	AB2C24D28 (1)
Weight, g/mol:	412.257772
ΔH_f, kcal/mol:	-102.12
Dipole, Da:	3.95
IP(EA), eV:	-8.88(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(E)-but-2-enoxy]-2,3-difluoro-4-[4-(4-pentylcyclohexyl)phenyl]benzene

Drug info:

PubChemData

Smile

CCCC1CCC(CC1)C2=CC=C(C=C2)C3=C(C(=C(C=C3)OCC=C)F)F

DOS

IR

Vibrations