Geometry & MOs

Info

ID:	282159
PubChem CID:	103917587
Reduced:	ON2C16H28 (1)
Stoich.:	AB2C16D28 (1)
Weight, g/mol:	329.091949
ΔH_f, kcal/mol:	-71.61
Dipole, Da:	3.97
IP(EA), eV:	-8.93(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-fluoro-N-(3-methylsulfanylcyclopentyl)-1,1-dioxo-3,4-dihydro-2H-thiochromen-4-amine

Drug info:

PubChemData

Smile

CC1=CC(=NC(=C1C(C)NC(CCO)C(C)C)C)C

DOS

IR

Vibrations