Geometry & MOs

Info

ID:	411847
PubChem CID:	135084692
Reduced:	SC13H16 (1)
Stoich.:	AB13C16 (1)
Weight, g/mol:	207.105942
ΔH_f, kcal/mol:	50.81
Dipole, Da:	2.03
IP(EA), eV:	-8.2(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-fluoroanilino)cyclohexan-1-one

Drug info:

PubChemData

Smile

CCCCSC#CC1=CC=C(C=C1)C

DOS

IR

Vibrations