Geometry & MOs

Info

ID:	140056
PubChem CID:	52638303
Reduced:	FSN3O4C21H22 (1)
Stoich.:	ABC3D4E21F22 (1)
Weight, g/mol:	432.148571
ΔH_f, kcal/mol:	-154.68
Dipole, Da:	11.18
IP(EA), eV:	-9.41(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[[2-chloro-5-[methyl(propan-2-yl)sulfamoyl]benzoyl]-(2-methylpropyl)amino]acetate

Drug info:

PubChemData

Smile

C1CC(C1)(C2=CC(=CC=C2)F)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCNC(=O)C4

DOS

IR

Vibrations