Geometry & MOs

Info

ID:	376387
PubChem CID:	134222399
Reduced:	O5F6C28H30 (1)
Stoich.:	A5B6C28D30 (1)
Weight, g/mol:	516.152399
ΔH_f, kcal/mol:	-497.31
Dipole, Da:	9.6
IP(EA), eV:	-9.4(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCCC12COC(OC1)(OC2)C3CCC(CC3)C(OC4=CC(=C(C=C4)C5=CC(=C(C(=C5)F)OCF)F)F)(F)F

DOS

IR

Vibrations