Geometry & MOs

Info

ID:	281414
PubChem CID:	103913838
Reduced:	NO2S2F3C9H16 (1)
Stoich.:	AB2C2D3E9F16 (1)
Weight, g/mol:	279.057456
ΔH_f, kcal/mol:	-261.87
Dipole, Da:	4.8
IP(EA), eV:	-9.32(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethylsulfonyl-N-[2-(trifluoromethylsulfanyl)ethyl]propan-2-amine

Drug info:

PubChemData

Smile

CS(=O)(=O)C1CCCC1NCCSC(F)(F)F

DOS

IR

Vibrations