Geometry & MOs

Info

ID:	353781
PubChem CID:	127285417
Reduced:	FNO2S2C12H16 (1)
Stoich.:	ABC2D2E12F16 (1)
Weight, g/mol:	237.085721
ΔH_f, kcal/mol:	-113.03
Dipole, Da:	7.81
IP(EA), eV:	-8.5(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-methylbutylsulfonyl)thiomorpholine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)S(=O)(=O)N2CCCSCC2)F

DOS

IR

Vibrations