Geometry & MOs

Info

ID:	35083
PubChem CID:	7979286
Reduced:	SN2O3H18C21 (1)
Stoich.:	AB2C3D18E21 (1)
Weight, g/mol:	399.072277
ΔH_f, kcal/mol:	-46.96
Dipole, Da:	3.2
IP(EA), eV:	-9.23(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-diethyl-4-fluoro-3-[(thiophene-2-carbonylamino)carbamoyl]benzenesulfonamide

Drug info:

PubChemData

Smile

C1C[C@]2(N(C1=O)[C@@H](CS2)C(=O)OCC3=CC=C(C=C3)C#N)C4=CC=CC=C4

DOS

IR

Vibrations