Geometry & MOs

Info

ID:	310699
PubChem CID:	126584396
Reduced:	ClFSN2O2H14C16 (1)
Stoich.:	ABCD2E2F14G16 (1)
Weight, g/mol:	340.06994
ΔH_f, kcal/mol:	-56.79
Dipole, Da:	3.34
IP(EA), eV:	-8.69(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(fluoromethoxy)-4-(4-iodocyclohexyl)cyclohexane

Drug info:

PubChemData

Smile

C1=CC2=C(C=C1F)NC=C2C3=C(C=C(C=C3)S(=O)NCCO)Cl

DOS

IR

Vibrations