Geometry & MOs

Info

ID:	376367
PubChem CID:	134222379
Reduced:	O2F5C23H25 (1)
Stoich.:	A2B5C23D25 (1)
Weight, g/mol:	408.207628
ΔH_f, kcal/mol:	-326.2
Dipole, Da:	3.85
IP(EA), eV:	-9.15(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCCC1CCC(CC1)C(OC2=CC(=C(C=C2)C3=CC(=C(C=C3)OCF)F)F)(F)F

DOS

IR

Vibrations