Geometry & MOs

Info

ID:	444873
PubChem CID:	135263788
Reduced:	NSF3O4C7H14 (1)
Stoich.:	ABC3D4E7F14 (1)
Weight, g/mol:	283.070128
ΔH_f, kcal/mol:	-336.22
Dipole, Da:	5.42
IP(EA), eV:	-9.44(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-aminoethanethiol;propane-1,2,3-triol;2,2,2-trifluoroacetic acid

Drug info:

PubChemData

Smile

C(CS)N.C(C(CO)OC(=O)C(F)(F)F)O

DOS

IR

Vibrations