Geometry & MOs

Info

ID:	274417
PubChem CID:	103809170
Reduced:	OSN2F3C9H17 (1)
Stoich.:	ABC2D3E9F17 (1)
Weight, g/mol:	246.064983
ΔH_f, kcal/mol:	-236.88
Dipole, Da:	3.39
IP(EA), eV:	-9.71(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-aminoethoxy)-N-[2-(trifluoromethylsulfanyl)ethyl]acetamide

Drug info:

PubChemData

Smile

CC(C)(CCC(=O)NCCSC(F)(F)F)N

DOS

IR

Vibrations