Geometry & MOs

Info

ID:	376769
PubChem CID:	134222795
Reduced:	O2F7H27C29 (1)
Stoich.:	A2B7C27D29 (1)
Weight, g/mol:	574.17542
ΔH_f, kcal/mol:	-378.98
Dipole, Da:	9.03
IP(EA), eV:	-9.64(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[difluoro-[3-fluoro-4-(trifluoromethoxy)phenoxy]methyl]phenyl]-4-[4-(ethoxymethyl)cyclohexyl]-2,3-difluorobenzene

Drug info:

PubChemData

Smile

CCOCCC1CCC(CC1)C2=CC=C(C=C2)C3=CC(=C(C(=C3)F)C(OC4=CC(=C(C(=C4)F)F)F)(F)F)F

DOS

IR

Vibrations