Geometry & MOs

Info

ID:	444763
PubChem CID:	135263498
Reduced:	FN2O2C6H13 (1)
Stoich.:	AB2C2D6E13 (1)
Weight, g/mol:	235.996629
ΔH_f, kcal/mol:	-149.59
Dipole, Da:	2.46
IP(EA), eV:	-9.68(0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-methyl-3-(trifluoromethylsulfonyloxy)propanoic acid

Drug info:

PubChemData

Smile

C(CNC(=O)OCCN)CF

DOS

IR

Vibrations