Geometry & MOs

Info

ID:	376341
PubChem CID:	134222352
Reduced:	O2F6H18C23 (1)
Stoich.:	A2B6C18D23 (1)
Weight, g/mol:	580.164855
ΔH_f, kcal/mol:	-323.05
Dipole, Da:	6.62
IP(EA), eV:	-9.48(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[3,5-difluoro-4-(fluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluoro-5-[2-fluoro-4-(4-pentylphenyl)phenyl]benzene

Drug info:

PubChemData

Smile

CCCC1=CC=C(C=C1)C(OC2=CC(=C(C=C2)C3=CC(=C(C(=C3)F)OCF)F)F)(F)F

DOS

IR

Vibrations