Geometry & MOs

Info

ID:	294720
PubChem CID:	117485579
Reduced:	FNSO3C14H20 (1)
Stoich.:	ABCD3E14F20 (1)
Weight, g/mol:	301.114793
ΔH_f, kcal/mol:	-168.26
Dipole, Da:	8.05
IP(EA), eV:	-9.71(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-fluoro-2-methoxy-3-methylsulfonylphenyl)cyclohexan-1-amine

Drug info:

PubChemData

Smile

COC1=C(C(=CC(=C1)C2(CCCC2)CN)F)S(=O)(=O)C

DOS

IR

Vibrations