Geometry & MOs

Info

ID:	32807
PubChem CID:	7848589
Reduced:	ClFNSO3H13C17 (1)
Stoich.:	ABCDE3F13G17 (1)
Weight, g/mol:	421.135922
ΔH_f, kcal/mol:	-130.94
Dipole, Da:	1.27
IP(EA), eV:	-8.79(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2,5-diethylphenyl)-2-oxoethyl] 2-[(4-fluorophenyl)sulfonyl-methylamino]acetate

Drug info:

PubChemData

Smile

C1CSC2=C(C=C(C=C2)C(=O)OCC3=C(C=CC=C3Cl)F)NC1=O

DOS

IR

Vibrations