Geometry & MOs

Info

ID:	86507
PubChem CID:	49886414
Reduced:	ClFNSO4C10H11 (1)
Stoich.:	ABCDE4F10G11 (1)
Weight, g/mol:	309.023785
ΔH_f, kcal/mol:	-198.01
Dipole, Da:	3.27
IP(EA), eV:	-9.72(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(5-chloro-2-fluoro-N-methylsulfonylanilino)acetate

Drug info:

PubChemData

Smile

COC(=O)CN(C1=C(C=C(C=C1)Cl)F)S(=O)(=O)C

DOS

IR

Vibrations