Geometry & MOs

Info

ID:	376827
PubChem CID:	134222854
Reduced:	OF4H11C14 (2)
Stoich.:	AB4C11D14 (2)
Weight, g/mol:	558.180505
ΔH_f, kcal/mol:	-402.32
Dipole, Da:	7.13
IP(EA), eV:	-9.6(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[difluoro-[3-fluoro-4-(3,4,5-trifluorophenyl)phenoxy]methyl]-1,3-difluoro-5-[4-(propoxymethyl)cyclohexyl]benzene

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations