Geometry & MOs

Info

ID:	63308
PubChem CID:	26750558
Reduced:	FSN3O5C22H24 (1)
Stoich.:	ABC3D5E22F24 (1)
Weight, g/mol:	406.119858
ΔH_f, kcal/mol:	-175.04
Dipole, Da:	6.04
IP(EA), eV:	-9.36(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-oxo-1-[2-(4-sulfamoylphenyl)ethylamino]propan-2-yl] 3-methoxybenzoate

Drug info:

PubChemData

Smile

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)CCC(=O)NNC(=O)/C=C/C3=CC=C(C=C3)F

DOS

IR

Vibrations