Geometry & MOs

Info

ID:	233108
PubChem CID:	87692419
Reduced:	O3F5H7C10 (1)
Stoich.:	A3B5C7D10 (1)
Weight, g/mol:	247.124215
ΔH_f, kcal/mol:	-353.86
Dipole, Da:	4.85
IP(EA), eV:	-10.28(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (4Z)-4-tert-butylsulfinylimino-2-methylbutanoate

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)OC(C(C(F)F)F)(F)F)C(=O)O

DOS

IR

Vibrations