Geometry & MOs

Info

ID:	376375
PubChem CID:	134222387
Reduced:	O2F5C25H25 (1)
Stoich.:	A2B5C25D25 (1)
Weight, g/mol:	570.124133
ΔH_f, kcal/mol:	-277.63
Dipole, Da:	6.08
IP(EA), eV:	-9.6(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC#CCCC1CCC(CC1)C2=CC=C(C=C2)C(OC3=CC(=C(C(=C3)F)OCF)F)(F)F

DOS

IR

Vibrations