Geometry & MOs

Info

ID:	70103
PubChem CID:	47207710
Reduced:	NS2O3C13H15 (1)
Stoich.:	AB2C3D13E15 (1)
Weight, g/mol:	301.114793
ΔH_f, kcal/mol:	-77.6
Dipole, Da:	7.26
IP(EA), eV:	-9.01(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-butan-2-yl-2-[1-(4-fluorophenyl)ethylsulfonyl]acetamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)OCC2=NC(=CS2)CS(=O)(=O)C

DOS

IR

Vibrations