Geometry & MOs

Info

ID:	86503
PubChem CID:	49886313
Reduced:	NSO4C13H19 (1)
Stoich.:	ABC4D13E19 (1)
Weight, g/mol:	414.97505
ΔH_f, kcal/mol:	-164.31
Dipole, Da:	5.25
IP(EA), eV:	-9.54(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl 2-(2-fluoro-4-iodo-N-methylsulfonylanilino)acetate

Drug info:

PubChemData

Smile

CC(C)OC(=O)CN(CC1=CC=CC=C1)S(=O)(=O)C

DOS

IR

Vibrations