Geometry & MOs

Info

ID:	376340
PubChem CID:	134222351
Reduced:	O2F5H23C29 (1)
Stoich.:	A2B5C23D29 (1)
Weight, g/mol:	440.121099
ΔH_f, kcal/mol:	-252.04
Dipole, Da:	6.28
IP(EA), eV:	-9.15(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[4-[difluoro-(4-propylphenyl)methoxy]-2-fluorophenyl]-1,3-difluoro-2-(fluoromethoxy)benzene

Drug info:

PubChemData

Smile

CCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)C(OC4=CC(=C(C(=C4)F)OCF)F)(F)F

DOS

IR

Vibrations