Geometry & MOs

Info

ID:	278868
PubChem CID:	103839232
Reduced:	BrClNOSC11H13 (1)
Stoich.:	ABCDEF11G13 (1)
Weight, g/mol:	233.049748
ΔH_f, kcal/mol:	-40.23
Dipole, Da:	2.46
IP(EA), eV:	-8.94(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2,3,3-tetrafluoro-N-(2-methylsulfanylpropyl)propanamide

Drug info:

PubChemData

Smile

CC(CNC(=O)C1=C(C=C(C=C1)Cl)Br)SC

DOS

IR

Vibrations