Geometry & MOs

Info

ID:	70045
PubChem CID:	47207165
Reduced:	FNSO3C11H14 (1)
Stoich.:	ABCD3E11F14 (1)
Weight, g/mol:	273.083493
ΔH_f, kcal/mol:	-163.47
Dipole, Da:	4.94
IP(EA), eV:	-10.03(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethylsulfonyl-N-[(4-fluorophenyl)methyl]propanamide

Drug info:

PubChemData

Smile

CCS(=O)(=O)CC(=O)NCC1=CC=CC=C1F

DOS

IR

Vibrations