Geometry & MOs

Info

ID:	376292
PubChem CID:	134222302
Reduced:	O4F7H19C21 (1)
Stoich.:	A4B7C19D21 (1)
Weight, g/mol:	344.195172
ΔH_f, kcal/mol:	-474.21
Dipole, Da:	5.71
IP(EA), eV:	-9.67(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(fluoromethoxy)-4-[4-[4-(3-fluoropropyl)cyclohexyl]phenyl]benzene

Drug info:

PubChemData

Smile

CCCC1COC(OC1)C2=CC(=C(C(=C2)F)C(OC3=CC(=C(C(=C3)F)OCF)F)(F)F)F

DOS

IR

Vibrations