Geometry & MOs

Info

ID:	376309
PubChem CID:	134222319
Reduced:	O2F7H19C25 (1)
Stoich.:	A2B7C19D25 (1)
Weight, g/mol:	364.165014
ΔH_f, kcal/mol:	-354.66
Dipole, Da:	7.9
IP(EA), eV:	-9.64(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[3,5-difluoro-4-(fluoromethoxy)phenyl]phenyl]-5-propyloxane

Drug info:

PubChemData

Smile

C/C=C/CCC1=CC=C(C=C1)C2=CC(=C(C(=C2)F)C(OC3=CC(=C(C(=C3)F)OCF)F)(F)F)F

DOS

IR

Vibrations