Geometry & MOs

Info

ID:	376795
PubChem CID:	134222821
Reduced:	O2F7H23C28 (1)
Stoich.:	A2B7C23D28 (1)
Weight, g/mol:	526.174277
ΔH_f, kcal/mol:	-361.76
Dipole, Da:	7.77
IP(EA), eV:	-9.59(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[4-(3,4-difluorophenyl)-3-fluorophenoxy]-difluoromethyl]-4-[4-(ethoxymethyl)cyclohexyl]-2,3-difluorobenzene

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations