Geometry & MOs

Info

ID:	232343
PubChem CID:	87576035
Reduced:	NSF3O4C21H28 (1)
Stoich.:	ABC3D4E21F28 (1)
Weight, g/mol:	191.068414
ΔH_f, kcal/mol:	-313.48
Dipole, Da:	5.05
IP(EA), eV:	-8.47(-1.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCN1CC2C(CCC3(C2CC=C3OS(=O)(=O)C(F)(F)F)C)C4(C1=CC(=O)CC4)C

DOS

IR

Vibrations