Geometry & MOs

Info

ID:	376330
PubChem CID:	134222341
Reduced:	O3F5C22H29 (1)
Stoich.:	A3B5C22D29 (1)
Weight, g/mol:	480.171243
ΔH_f, kcal/mol:	-395.49
Dipole, Da:	4.1
IP(EA), eV:	-9.69(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[difluoro-[4-(fluoromethoxy)phenoxy]methyl]phenyl]-2-fluoro-4-(4-propylphenyl)benzene

Drug info:

PubChemData

Smile

CCCC1CCC(CC1)C2CCC(OC2)C(OC3=CC(=C(C(=C3)F)OCF)F)(F)F

DOS

IR

Vibrations