Geometry & MOs

Info

ID:	376778
PubChem CID:	134222804
Reduced:	OF4H12C14 (2)
Stoich.:	AB4C12D14 (2)
Weight, g/mol:	530.205577
ΔH_f, kcal/mol:	-426.89
Dipole, Da:	9.96
IP(EA), eV:	-9.74(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[difluoro-(3,4,5-trifluorophenoxy)methyl]-5-[4-[4-(ethoxymethyl)cyclohexyl]cyclohexen-1-yl]-1,3-difluorobenzene

Drug info:

PubChemData

Smile

CCOCC1CCC(CC1)C2=CC(=C(C(=C2)F)C(OC3=CC(=C(C(=C3)F)C4=CC(=C(C=C4)F)F)F)(F)F)F

DOS

IR

Vibrations