Geometry & MOs

Info

ID:	18166
PubChem CID:	538640
Reduced:	NSO3F5C6H8 (1)
Stoich.:	ABC3D5E6F8 (1)
Weight, g/mol:	269.014505
ΔH_f, kcal/mol:	-369.3
Dipole, Da:	4.47
IP(EA), eV:	-11.01(-1.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-acetyl-3-oxo-N-(pentafluoro-lambda6-sulfanyl)butanamide

Drug info:

PubChemData

Smile

CC(=O)C(C(=O)C)C(=O)NS(F)(F)(F)(F)F

DOS

IR

Vibrations