Geometry & MOs

Info

ID:	154337
PubChem CID:	56313753
Reduced:	Cl2O2F3N3C17H18 (1)
Stoich.:	A2B2C3D3E17F18 (1)
Weight, g/mol:	421.149384
ΔH_f, kcal/mol:	-209.45
Dipole, Da:	5.54
IP(EA), eV:	-8.98(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(4-methylphenyl)sulfamoyl]-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)N1C(=C(C=N1)C(=O)NCCCOC2=C(C=C(C=C2)Cl)Cl)C(F)(F)F

DOS

IR

Vibrations